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• Amoxapine
IUPAC Name: 8-chloro-6-piperazin-1-ylbenzo[b][1,5]benzoxazepine | CAS Registry Number: 14028-44-5
Synonyms: amoxapine, Asendin, Amoxepine, Demolox, Moxadil, Amoxan, Desmethylloxapin, Desmethylloxapine, Prestwick_503, Asendin (TN), Amoxapinum [INN-Latin], Amoxapina [INN-Spanish], Spectrum_000446, Lopac-A-129, Prestwick0_000102, Prestwick1_000102, Prestwick2_000102, Prestwick3_000102, Spectrum2_001245, Spectrum3_001067

Molecular Formula: C17H16ClN3OMolecular Weight: 313.781440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QWGDMFLQWFTERH-UHFFFAOYSA-N

• Amoxicillin Sodium
IUPAC Name: sodium (2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | CAS Registry Number: 34642-77-8
Synonyms: Acuotricina, Quimiopen, Trifamox, Amitron, Alfida, Amoxicillin sodium, Amoxicillin natrium, Alfoxil Enjektabl, Agram IM, Riotapen [inj.], Ibiamox [inj.], Moxacin [inj.], Penamox [inj.], Lamoxy [inj.], Danoxillin [inj.], Novabritine [inj.], Amoxicillin sodium (USAN), Amoxicillin sodium [USAN], BRL 23333AB-B, CHEBI:51255

Molecular Formula: C16H18N3NaO5SMolecular Weight: 387.385990 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: BYHDFCISJXIVBV-YWUHCJSESA-M

• Amoxicillin trihydrate
IUPAC Name: (2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid trihydrate | CAS Registry Number: 61336-70-7
Synonyms: amoxicillin, Amoxil, Amoksicillin, Kentrocyllin, Matasedrin, Novabritine, Paradroxil, Zamocillin, Zamocilline, Amoxidal, Amoxillat, Amoxipen, Augmentin, Benzoral, Clamoxyl, Flemoxine, Galenamox, Gramidil, Hiconcil, Himinomax

Molecular Formula: C16H25N3O8SMolecular Weight: 419.450000 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 9

InChIKey: MQXQVCLAUDMCEF-CWLIKTDRSA-N

• Amphotericin B
IUPAC Name: (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,19E,21E,23E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid | CAS Registry Number: 1397-89-3
Synonyms: amphotericin b, Fungizone, Ambisome, Ampho-Moronal, Amphotericin, Amphocin, Amphotec, Amphozone, Fungilin, Fungisome, Talsutin, Abelcet, Tegopen, Amphotericine B, Mysteclin-F, Fungizone (TN), Amphotec (TN), AmBisome (TN), ABLC, AMPH-B

Molecular Formula: C47H73NO17Molecular Weight: 924.079020 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 18

InChIKey: APKFDSVGJQXUKY-INPOYWNPSA-N

• Ampicillin
IUPAC Name: (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid | CAS Registry Number: 69-53-4
Synonyms: ampicillin, Omnipen, Ampicillin acid, Tokiocillin, Principen, Synpenin, Amcill, D-Ampicillin, Bonapicillin, Racenacillin, Totalciclina, Adobacillin, Ampicilline, Amplacilina, Amplipenyl, Campicillin, Copharcilin, Divercillin, Doktacillin, Duphacillin

Molecular Formula: C16H19N3O4SMolecular Weight: 349.404760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: AVKUERGKIZMTKX-NJBDSQKTSA-N

• Ampicillin sodium
IUPAC Name: sodium (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | CAS Registry Number: 69-52-3
Synonyms: ampicillin, Viccillin, Ampiplus Simplex, Sodium ampicillin, AMPICILLIN SODIUM, Omnipen-N, Ampicillin sodium salt, Ampicillin natrium, Viccillin (TN), Prestwick_822, Omnipen-N (TN), MLS000028726, A0166_SIGMA, A8351_SIGMA, SPECTRUM1500123, A2804_SIAL, A9518_SIAL, Ampicillin sodium (JP15/USP), CHEBI:34535, SMR000059229

Molecular Formula: C16H18N3NaO4SMolecular Weight: 371.386590 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: KLOHDWPABZXLGI-YWUHCJSESA-M

• Ampicillin Trihydrate
IUPAC Name: (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid trihydrate | CAS Registry Number: 7177-48-2
Synonyms: Polycillin, Trafarbiot, Ampinova, Amperil, Amcill, Amcap, Cymbi, ampicillin, ukopen, vidopen, Divercillin, Princillin, Probampacin, Totacillin, Ampichel, Lifeampil, Penbritin, Principen, Acillin, Ampikel

Molecular Formula: C16H25N3O7SMolecular Weight: 403.450600 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: RXDALBZNGVATNY-CWLIKTDRSA-N

• Amprolium Hydrochloride
IUPAC Name: 5-[(2-methylpyridin-1-ium-1-yl)methyl]-2-propylpyrimidin-4-amine chloride hydrochloride | CAS Registry Number: 137-88-2
Synonyms: amprolium, Amprolium hydrochloride, Mepyrium, Amprol, Thiacoccid, Amprolsol vet, Corid vet, Amprol 25, Amprol 25 per cent, Corid 20%, Amprolium (TN), Prestwick_880, MLS002154169, A0542_SIGMA, SPECTRUM1500124, 46062_RIEDEL, EINECS 205-307-5, CID8732, NSC 523454, EINECS 221-272-9

Molecular Formula: C14H20Cl2N4Molecular Weight: 315.241400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PJBQYZZKGNOKNJ-UHFFFAOYSA-M

• Ampyrone
IUPAC Name: 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one | CAS Registry Number: 83-07-8
Synonyms: AMPYRONE, Metapirazone, 4-Aminoantipyrine, Aminoantipyrin, Aminoantipyrine, Aminoazophene, Solvapyrin-A, 4-Aminophenazone, 4-Aminoantipyrene, Aminoazophenazone, Solnapyrin-A, aminophenazone, Antipyrine, 4-amino-, Prestwick_16, 4-AAP, Spectrum_000758, Prestwick0_000181, Prestwick1_000181, Prestwick2_000181, Prestwick3_000181

Molecular Formula: C11H13N3OMolecular Weight: 203.240420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RLFWWDJHLFCNIJ-UHFFFAOYSA-N

• Amrinone
IUPAC Name: 3-amino-5-pyridin-4-yl-1H-pyridin-2-one | CAS Registry Number: 60719-84-8
Synonyms: inamrinone, Wincoram, Inocor, Cordemcura, Amcoral, Cartonic, Cordarex, Amrinon, Inamrinone lactate, Prestwick_44, Amrinonum [INN-Latin], Inamrinone (USP), Amcoral (TN), Amrinona [INN-Spanish], Amrinone (JAN/INN), Spectrum_001350, Prestwick0_000800, Prestwick1_000800, Prestwick2_000800, Prestwick3_000800

Molecular Formula: C10H9N3OMolecular Weight: 187.197960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: RNLQIBCLLYYYFJ-UHFFFAOYSA-N

• Amygdalin
IUPAC Name: (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile | CAS Registry Number: 29883-15-6
Synonyms: amygdalin, D-Amygdalin, (R)-Laenitrile, (R)-Amygdaloside, (R)-Amygdalin, STOCK1N-52529, CHEBI:17019, SMP1_000103, D(-)-Mandelonitrile-beta-D-gentiobioside, (-)-D-mandelonitrile beta-D-gentiobioside, TL8002322, C08325, D-Mandelonitrile-beta-D-glucosido-6-beta-D-glucoside, (2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile

Molecular Formula: C20H27NO11Molecular Weight: 457.428480 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 12

InChIKey: XUCIJNAGGSZNQT-JHSLDZJXSA-N

• Amyl Acetate
IUPAC Name: pentyl acetate | CAS Registry Number: 628-63-7
Synonyms: Pentyl acetate, Amyl acetate, n-Amyl acetate, Birnenoel, Pent-acetate, Banana oil, Chlordantoin, Pear oil, 1-Pentyl acetate, n-Pentyl ethanoate, Pent-acetate 28, Amylazetat, Amyl acetic ester, Amyl acetic ether, Prim-amyl acetate, Acetic acid, pentyl ester, Octan amylu, Acetate d'amyle, Amyl acetate, n-, 1-Pentanol acetate

Molecular Formula: C7H14O2Molecular Weight: 130.184860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PGMYKACGEOXYJE-UHFFFAOYSA-N

• Amyl Benzoate
IUPAC Name: pentyl benzoate | CAS Registry Number: 2049-96-9
Synonyms: Amyl benzoate, n-Pentyl benzoate, PENTYL BENZOATE, Benzoic acid, pentyl ester, EINECS 218-077-6, BRN 2046708, ZINC02038955, AI3-07998, LS-38113, ST5406087, 4-09-00-00292 (Beilstein Handbook Reference)

Molecular Formula: C12H16O2Molecular Weight: 192.254240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QKNZNUNCDJZTCH-UHFFFAOYSA-N

• Amyl Vinyl Carbinol
IUPAC Name: oct-1-en-3-ol | CAS Registry Number: 3391-86-4
Synonyms: Amyl vinyl carbinol, 1-Vinylhexanol, 1-OCTEN-3-OL, Vinyl amyl carbinol, Amylvinylcarbinol, Matsuica alcohol, Matsutake alcohol, 3-Hydroxy-1-octene, Pentylvinylcarbinol, Vinyl hexanol, 3-Octenol, Mushroom alcohol, Pentyl vinyl carbinol, Oct-1-ene-3-ol, Oct-1-en-3-ol, octene-1-ol-3, 1-Okten-3-ol [Czech], 1-Octen-3-ol (natural), Matsutake alcohol [Japanese], FEMA No. 2805

Molecular Formula: C8H16OMolecular Weight: 128.212040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VSMOENVRRABVKN-UHFFFAOYSA-N

• Amylamines
IUPAC Name: pentan-1-amine | CAS Registry Number: 110-58-7
Synonyms: Amylamine, Pentylamine, 1-Pentanamine, Monoamylamine, Norleucamine, 1-Aminopentane, n-Pentylamine, 1-Pentylamine, N-AMYLAMINE, pentan-1-amine, CCRIS 6210, W424201_ALDRICH, Amylamines, mixture of isomers, 171409_ALDRICH, 473316_ALDRICH, NSC 7906, 77059_FLUKA, 77060_FLUKA, EINECS 203-780-2, NSC7906

Molecular Formula: C5H13NMolecular Weight: 87.163420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DPBLXKKOBLCELK-UHFFFAOYSA-N

• Amylmethylamine
IUPAC Name: N-methylpentan-1-amine | CAS Registry Number: 25419-06-1
Synonyms: N-Methylpentylamine, Pentylamine, N-methyl-, 1-Pentanamine, N-methyl-, 496138_ALDRICH, EINECS 246-966-9, BBV-053209

Molecular Formula: C6H15NMolecular Weight: 101.190000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UOIWOHLIGKIYFE-UHFFFAOYSA-N

• Anabasine
IUPAC Name: 3-[(2S)-piperidin-2-yl]pyridine | CAS Registry Number: 494-52-0
Synonyms: Neonicotine, Neonikotin, Anabasin, Anabazin, (-)-Anabasine, (S)-anabasine, S-(-)-Anabasine, Tocris-1971, CHEBI:74, 2-(3'-Pyridyl) piperidine, L-3-(2'-Piperidyl)pyridine, Piperidine, 2-(3-pyridyl)-, Pyridine, 3-(2-piperidyl)-, WLN: T6NJ C- BT6MTJ, ZERO/001717, (-)-2-(3'-Pyridyl)piperidine, 3-[(2S)-piperidin-2-yl]pyridine, NSC87504, CID205586, NCGC00016468-01

Molecular Formula: C10H14N2Molecular Weight: 162.231560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MTXSIJUGVMTTMU-JTQLQIEISA-N

• Anaesthetic Ether
IUPAC Name: ethoxyethane | CAS Registry Number: 60-29-7
Synonyms: ether, Ethyl ether, DIETHYL ETHER, Ethoxyethane, Anesthetic ether, Pronarcol, Diethyl oxide, Ethyl oxide, Aether, Ether, ethyl, Solvent ether, Anesthesia ether, Anaesthetic ether, 3-Oxapentane, Ethane, 1,1'-oxybis-, 1,1'-oxydiethane, Diaethylaether, Diethylaether, Ethylether, Dwuetylowy eter

Molecular Formula: C4H10OMolecular Weight: 74.121600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RTZKZFJDLAIYFH-UHFFFAOYSA-N

• Anavenol
IUPAC Name: 2-naphthalen-2-yloxyethanol | CAS Registry Number: 93-20-9
Synonyms: beta-Naphthoxyethanol, Ethoxylated 2-naphthol, .beta.-Naphthoxyethanol, Ethoxylated beta-naphthol, 2-(2-Naphthoxy)ethanol, 2-(2-NAPHTHYLOXY)ETHANOL, 2-(.beta.-Naphthoxy)ethanol, Ethanol, 2-(2-naphthalenyloxy)-, Ethanol, 2-(2-naphthyloxy)-, 2-(beta-Hydroxyethoxy)naphthalene, beta-Hydroxyethyl-2-naphthyl ether, Ethylene glycol mono-2-naphthyl ether, ALBB-008824, NSC37574, EINECS 202-228-8, 2-(.beta.-Hydroxyethoxy)naphthalene, beta-Hydroxyethyl beta-naphthol ether, NSC 37574, ZINC01670115, .beta.-Hydroxyethyl-2-naphthyl ether

Molecular Formula: C12H12O2Molecular Weight: 188.222480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BQPBZDSDFCDSAO-UHFFFAOYSA-N

• Ancitabine hydrochloride
Synonyms: Cyclocytidine, OCTD hydrochloride, Ancitabin hydrochlorid, Cyclo-cmp hydrochloride, Ancitabin hydrochloride, Cyclocytidine hydrochloride, ANCITABINE HYDROCHLORIDE, C9H11N3O4.HCl, MLS001032024, MLS001173324, 2,2'-Cyclocytidine hydrochloride, Ancitabine hydrochloride (JAN), 2,2'-Anhydrocytidine hydrochloride, 2,2'-O-Cyclocytidine hydrochloride, EINECS 233-515-6, 2,2'-Anhydrocytarabine hydrochloride, 2,2'-Anhydroaracytidine hydrochloride, 2,2'-Cyclocytidine, monohydrochloride, NSC 145668, NSC-145668

Molecular Formula: C9H12ClN3O4Molecular Weight: 261.662280 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: KZOWNALBTMILAP-JBMRGDGGSA-N

• Angiotensin II human
IUPAC Name: (3S)-3-amino-4-[[(2S)-5-(diaminomethylideneamino)-1-[[(2R)-1-[[(2S)-1-[[(3S)-1-[[(2S)-1-[(2S)-2-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-oxobutanoic acid | CAS Registry Number: 4474-91-3
Synonyms: Delivert, Delivert (TN), ANGIOTENSIN II, Angiotensin II (human type), Angiotensin II (human type) (JAN), D02014

Molecular Formula: C50H71N13O12Molecular Weight: 1046.178640 [g/mol]
H-Bond Donor: 13H-Bond Acceptor: 18

InChIKey: CZGUSIXMZVURDU-QDFSPCTPSA-N

• Anhydrous Borax
IUPAC Name: 4-octylbenzoic acid | CAS Registry Number: 1330-43-4
Synonyms: 4-Octylbenzoic acid, Antipyonin, Tronabor, Borascu, Boricin, Polybor, Solubor, Jaikin, Neobor, p-Octylbenzoic acid, Anhydrous borax, Gerstley borate, Sodium biborate, Borax granular, Bura, Gertley borate, Sodium tetraborate, Sodium borate, Puffed borax, Borax glass

Molecular Formula: C15H22O2Molecular Weight: 234.333980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZQLDNJKHLQOJGE-UHFFFAOYSA-N

• Anhydrous Caustic Soda
IUPAC Name: sodium;hydroxide | CAS Registry Number: 1310-73-2
Synonyms: SODIUM HYDROXIDE, Caustic soda, Sodium hydrate, Soda lye, White caustic, Sodium hydroxide (Na(OH)), Aetznatron, Ascarite, Sodium hydroxide solution, Soda, caustic, Natriumhydroxid, Rohrputz, Plung, Collo-Grillrein, Liquid-plumr, Caustic soda solution, Collo-Tapetta, Fuers Rohr, Rohrreiniger Rofix, NaOH

Molecular Formula: HNaOMolecular Weight: 39.997 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HEMHJVSKTPXQMS-UHFFFAOYSA-M

• Anhydrous Hydrofluoric Acid
IUPAC Name: hydrogen fluoride | CAS Registry Number: 7664-39-3
Synonyms: Hydrogen fluoride, Hydrofluoride, Rubigine, Fluorhydric acid, fluorane, fluorum, Hydrogenfluorid, fluoridohydrogen, Fluor, Fluorwasserstoff, Antisal 2B, HYDROFLUORIC ACID, Fluorowodor [Polish], Caswell No. 484, fluorure d'hydrogene, Fluorwaterstof [Dutch], FLUORINE, Hydrogen fluoride (HF), FLUORO GROUP, Fluorwasserstoff [German]

Molecular Formula: FHMolecular Weight: 20.006343 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KRHYYFGTRYWZRS-UHFFFAOYSA-N

• Anhydrous Hydrogen Chloride
IUPAC Name: hydrogen chloride | CAS Registry Number: 7647-01-0
Synonyms: hydrochloric acid, hydrogen chloride, hydrochloride, Muriatic acid, Bowl Cleaner, chlorane, chlorum, Spirits of salt, Hydrogenchlorid, Chlorohydric acid, Chlore, chloridohydrogen, Chlor, Chlorwasserstoff, Cloro, Acid, Muriatic, Wasserstoffchlorid, 4-D Bowl Sanitizer, Acid, Hydrochloric, Chloride, Hydrogen

Molecular Formula: ClHMolecular Weight: 36.460940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: VEXZGXHMUGYJMC-UHFFFAOYSA-N

• Anhydrous Magnesium Sulphate
IUPAC Name: magnesium sulfate | CAS Registry Number: 7487-88-9
Synonyms: Magnesium sulphate, MAGNESIUM SULFATE, Epsom salts, Epsom salt, Sal Angalis, Magnesiumsulfat, Sal De sedlitz, Bitter salt, Tomix OT, Sulfate, Magnesium, Magnesium sulfate anhydrous, Caswell No. 534, OT-S (drying agent), Magnesium sulfate (1:1), MgSO4, OT-S, Magnesium(II) sulfate, Magnesium sulfate dried, Magnesium sulfate hydrate, Sulfuric acid magnesium salt

Molecular Formula: MgO4SMolecular Weight: 120.367600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: CSNNHWWHGAXBCP-UHFFFAOYSA-L

• Anhydrous Methanol
IUPAC Name: methanol | CAS Registry Number: 67-56-1
Synonyms: methanol, methyl alcohol, carbinol, wood alcohol, Wood naphtha, Wood spirit, Methylol, Colonial Spirit, Methyl hydroxide, Pyroxylic spirit, Columbian Spirit, Monohydroxymethane, Alcohol, methyl, Columbian spirits, Methyl hydrate, Colonial spirits, Methylalkohol, Pyroxylic spirits, alcohol, MeOH

Molecular Formula: CH4OMolecular Weight: 32.041860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: OKKJLVBELUTLKV-UHFFFAOYSA-N

• Anhydrous Potassium Fluoride
IUPAC Name: potassium fluoride | CAS Registry Number: 7789-23-3
Synonyms: POTASSIUM FLUORIDE, Potassium fluoride (KF), Potassium fluorure [French], Potassium fluoride solution, CCRIS 1568, Fluorure de potassium [French], Potassium fluoride on Celite, Potassium fluoride on alumina, 229814_ALDRICH, 262552_ALDRICH, 316385_ALDRICH, 449148_ALDRICH, 611913_ALDRICH, 60238_FLUKA, 60239_FLUKA, 60240_FLUKA, 60244_FLUKA, EINECS 232-151-5, HSDB 7481, UN1812

Molecular Formula: FKMolecular Weight: 58.096703 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NROKBHXJSPEDAR-UHFFFAOYSA-M

• Anhydrous Sodium Sulphate
IUPAC Name: disodium sulfate | CAS Registry Number: 7757-82-6
Synonyms: Disodium sulfate, Salt cake, Disodium sulphate, Kemsol, Sodium sulphate, Bisodium sulfate, SODIUM SULFATE, Sulfate, sodium, Natriumsulfat, Disodium monosulfate, Dibasic sodium sulfate, Natriumsulfat (German), Sodium sulfate anhydrous, Sodium sulfate, dried, Sulfuric acid disodium salt, Caswell No. 793, Sodium sulfate (2:1), Sodium sulfate anhydous, Sodium sulfate solution, Sodium sulfate (Na2SO4)

Molecular Formula: Na2O4SMolecular Weight: 142.042140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: PMZURENOXWZQFD-UHFFFAOYSA-L

• Anhydrous Sodium Sulphide
IUPAC Name: disodium sulfanide | CAS Registry Number: 1313-82-2
Synonyms: Disodium sulfide, SODIUM SULFIDE, Sodium sulphide, Sodium monosulfide, Sodum sulfuret, Disodium sulphide, Disodium monosulfide, Sodium sulfide (Na2S), Na2S, Sodium sulfide hydrate, Sodium sulfide (VAN), Na2-S, Sodium sulfide, anhydrous, Disodium sulfide (Na2S), Sodium sulfide (anhydrous), 13468_RIEDEL, 407410_ALDRICH, HSDB 772, 71975_FLUKA, Sodium sulfide, anhydrous (DOT)

Molecular Formula: HNa2S+Molecular Weight: 79.052480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VDQVEACBQKUUSU-UHFFFAOYSA-M

• Anhydrous Sodium Sulphite
IUPAC Name: sodium; sulfurous acid | CAS Registry Number: 7757-83-7
Synonyms: Caswell No. 794, Sulfurous acid, sodium salt, Sulphurous acid, sodium salt, EINECS 234-172-5, EPA Pesticide Chemical Code 078203, 10579-83-6

Molecular Formula: H2Na2O3SMolecular Weight: 128.058620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YKZJGZHPDUVUKN-UHFFFAOYSA-N

• Aniline 2,5-Disulphonic Acid
IUPAC Name: 2-aminobenzene-1,4-disulfonic acid | CAS Registry Number: 98-44-2
Synonyms: 2,5-Disulfoaniline, 4-Sulfometanilic acid, 2,5-Disulfo-1-aminobenzene, 2-Amino-1,4-disulfobenzene, Aniline-2,5-disulfonic acid, 1-Anilino-2,5-disulfonic acid, 2-Amino-p-benzenedisulfonic acid, WLN: WSQR BZ DSWQ, p-Benzenedisulfonic acid, 2-amino-, 1-Amino-2,5-benzenedisulfonic acid, 2-Amino-1,4-benzenedisulfonic acid, NSC 5580, EINECS 202-669-6, Kyselina anilin-2,5-disulfonova, NSC5580, 2-Aminobenzene-1,4-disulphonic acid, AIDS166701, AIDS-166701, 1-Aminobenzene-2,5-disulfonic acid, 2-Aminobenzene-1,4-disulfonic acid

Molecular Formula: C6H7NO6S2Molecular Weight: 253.252880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: LDCCBULMAFILCT-UHFFFAOYSA-N

• Aniline Hydrochloride
IUPAC Name: aniline hydrochloride | CAS Registry Number: 142-04-1
Synonyms: Aniline chloride, Anilinium chloride, Aniline.HCl, Chlorid anilinu, Sul anilinova, ''aniline Salt'', ANILINE HYDROCHLORIDE, Benzenamine, hydrochloride, Phenylamine hydrochloride, Phenylammonium chloride, Sul anilinova [Czech], Aniline, hydrochloride, Chlorhydrate d'aniline, Chlorid anilinu [Czech], hydrochloride benzenamine, Benzenamine hydrochloride, Hydrochloride benzenamide, USAF EK-442, CCRIS 45, NCI-C03736 hydrochloride

Molecular Formula: C6H8ClNMolecular Weight: 129.587420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: MMCPOSDMTGQNKG-UHFFFAOYSA-N

• Aniline Sulfate
IUPAC Name: aniline; sulfuric acid | CAS Registry Number: 542-16-5
Synonyms: ANILINE SULFATE, Dianilinium sulphate, Aniline sulfate salt, Benzenamine, sulfate (2:1), 285153_ALDRICH, 10421_FLUKA, CID10951, EINECS 208-805-0, 62-53-3

Molecular Formula: C12H16N2O4SMolecular Weight: 284.331440 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: FUKMEFZGEMVGLD-UHFFFAOYSA-N

• Anilinoacetaldehyde diethyl acetal
IUPAC Name: N-(2,2-diethoxyethyl)aniline | CAS Registry Number: 22758-34-5
Synonyms: N-(2,2-Diethoxyethyl)aniline, ZINC02510113

Molecular Formula: C12H19NO2Molecular Weight: 209.284760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DHGUGEBXVGPRRD-UHFFFAOYSA-N

• Aniracetam
IUPAC Name: 1-(4-methoxybenzoyl)pyrrolidin-2-one | CAS Registry Number: 72432-10-1
Synonyms: aniracetam, Draganon, Sarpul, Ampamet, Reset, Spectrum_001342, Tocris-0867, 1-anisoyl-2-pyrrolidinone, Aniracetamun [INN-Latin], Spectrum3_001553, Spectrum4_000761, Spectrum5_001609, Lopac-A-9950, 1-(4-Methoxybenzoyl)-2-pyrrolidinone, 1-p-Anisoyl-2-pyrrolidinone, Biomol-NT_000222, Aniracetam [USAN:INN:JAN], 1-p-anisoylpyrrolidin-2-one, Lopac0_000115, BSPBio_003026

Molecular Formula: C12H13NO3Molecular Weight: 219.236520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ZXNRTKGTQJPIJK-UHFFFAOYSA-N

• Anise alcohol
IUPAC Name: (4-methoxyphenyl)methanol | CAS Registry Number: 105-13-5
Synonyms: Anisyl alcohol, p-Anisyl alcohol, Anisic alcohol, p-Anisol alcohol, Anisalcohol, p-, Anis alcohol, JandaJel-Wang, Benzenemethanol, 4-methoxy-, p-Methoxybenzyl alcohol, Benzyl alcohol, p-methoxy-, 4-Methoxybenzenemethanol, 4-METHOXYBENZYL ALCOHOL, Anisyl alcohol (natural), (4-Methoxyphenyl)methanol, FEMA No. 2099, CCRIS 5111, WLN: Q1R DO1, W209902_ALDRICH, W209910_ALDRICH, 136905_ALDRICH

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MSHFRERJPWKJFX-UHFFFAOYSA-N

• Anisole
IUPAC Name: methoxybenzene | CAS Registry Number: 100-66-3
Synonyms: Methoxybenzene, ANISOLE, Benzene, methoxy-, Methyl phenyl ether, Anizol, Phenoxymethane, Benzene, methoxy, Anisol, Phenol methyl ether, Phenyl methyl ether, Ether, methyl phenyl, FEMA Number 2097, Ether, methyl phenyl-, HSDB 44, FEMA No. 2097, WLN: 1OR, 296295_ALDRICH, NSC 7920, 10520_FLUKA, 96109_FLUKA

Molecular Formula: C7H8OMolecular Weight: 108.137820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RDOXTESZEPMUJZ-UHFFFAOYSA-N

• Antazoline
IUPAC Name: N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline | CAS Registry Number: 91-75-8
Synonyms: antazoline, Antihistal, Phenazolin, Phenazoline, Antastan, Antasten, Antazolin, Antistin, Antistine, Histostab, Imidamin, Imidamine, Azalone, Analergine, Antazolina, Antazolinum, Vasocon-A, Ben-A-hist, Antazolinum [Latin], Antazolina [Spanish]

Molecular Formula: C17H19N3Molecular Weight: 265.352860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: REYFJDPCWQRWAA-UHFFFAOYSA-N

• Antazoline hydrochloride
IUPAC Name: N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline hydrochloride | CAS Registry Number: 2508-72-7
Synonyms: Fenazolina, Histazine, Phenazolinum, Prestwick_82, Antazolinium chloratum, Antistine hydrochloride, Phenazolinum (TN), Phenazoline hydrochloride, C17H19N3.HCl, MLS000028599, MLS001148371, MLS002153486, A9899_SIGMA, EINECS 219-719-8, NCGC00180986-01, LS-79573, SMR000058731, 2-(N-Benzylanilinomethyl)-2-imidazoline hydrochloride, 2-Phenylbenzylaminomethylimidazoline hydrochloride, D07459

Molecular Formula: C17H20ClN3Molecular Weight: 301.813800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SWKDMSRRIBZZAY-UHFFFAOYSA-N

• Anthracene
IUPAC Name: anthracene | CAS Registry Number: 120-12-7
Synonyms: ANTHRACENE, Anthracin, Paranaphthalene, Green Oil, acene, acenes, polyacenes, Tetra Olive N2G, Anthracen, Anthrazen, Anthracene, pure, Acen, Azen, Anthracen [German], Anthracene solution, Bis-alkylamino anthracene, CCRIS 767, HSDB 702, A89200_ALDRICH, 40076_SUPELCO

Molecular Formula: C14H10Molecular Weight: 178.229200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MWPLVEDNUUSJAV-UHFFFAOYSA-N

• Anthracene, 9-bromo-10-(1-naphthalenyl)-
IUPAC Name: 9-bromo-10-naphthalen-1-ylanthracene | CAS Registry Number: 400607-04-7
Synonyms: 9-bromo-10-(naphthalen-1-yl)anthracene, 9-Bromo-10-(1-naphthalenyl)anthracene, 9-Bromo-10-naphthalen-1-yl-anthracene, CTK1D4876, MolPort-019-918-628, ANW-29263, QC-605, ZINC49588493, AKOS015835052, AC-5806, AG-L-23199, RL03532, 10-bromo-9-(naphthalen-1-yl)anthracene, AK-49136, BR-49136, KB-47416, Anthracene, 9-bromo-10-(1-naphthalenyl), 10-(naphthalene-1-yl)-9-bromo anthracene, A6692, AM20040388

Molecular Formula: C24H15BrMolecular Weight: 383.279900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SYACRXBYRNYMLN-UHFFFAOYSA-N

• Anthracene-9-carboxylic acid
IUPAC Name: anthracene-9-carboxylic acid | CAS Registry Number: 723-62-6
Synonyms: 9-Anthroic acid, 9-Anthracenecarboxylic acid, 9-Carboxyanthracene, ANCA, anthracene-9-carboxylic acid, 9-AC cpd, Spectrum_001457, Tocris-0963, Spectrum3_001767, Spectrum4_000875, Spectrum5_001807, 9-ACA, 9-anthracene carboxylic acid, A89405_ALDRICH, BSPBio_003233, KBioGR_001569, KBioSS_001937, 9-anthroic acid, sodium salt, Anthracene-10-carboxylic acid, DivK1c_000919

Molecular Formula: C15H10O2Molecular Weight: 222.238700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XGWFJBFNAQHLEF-UHFFFAOYSA-N

• Anthracene-9-Methanol
IUPAC Name: anthracen-9-ylmethanol | CAS Registry Number: 1468-95-7
Synonyms: 9-Anthracenemethanol, 9-Anthrylcarbinol, 9-Anthrylmethanol, 9-Methylolanthracene, 9-Hydroxymethylantracene, Anthracene-9-carbinol, 9-Hydroxymethylanthracene, 9-(Hydroxymethyl)anthracene, CCRIS 7297, 187240_ALDRICH, EINECS 215-998-5, NSC 241166, 9-ANTHRACENE METHYL CARBINOL, BRN 1873402, NSC241166, ZINC01763653, LS-20355, TL8001030, PB247694202, 4-06-00-04944 (Beilstein Handbook Reference)

Molecular Formula: C15H12OMolecular Weight: 208.255180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JCJNNHDZTLRSGN-UHFFFAOYSA-N

• Anthranilic Acid
IUPAC Name: 2-aminobenzoic acid | CAS Registry Number: 118-92-3
Synonyms: anthranilic acid, 2-aminobenzoic acid, o-Carboxyaniline, o-aminobenzoic acid, vitamin L1, 2-Carboxyaniline, anthranilate, o-Anthranilic acid, Carboxyaniline, 2-aminobenzoate, Benzoic acid, 2-amino-, Vitamin L, Cupric anthranilate, o-Aminobenzoesaeure, AMINOBENZOIC ACID, 2-Aminobenzoesaeure, 2-Carboxyphenylamine, ortho-Aminobenzoic acid, Caswell No. 033G, 1-Amino-2-carboxybenzene

Molecular Formula: C7H7NO2Molecular Weight: 137.135980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: RWZYAGGXGHYGMB-UHFFFAOYSA-N

• Anthraquinone
IUPAC Name: anthracene-9,10-dione | CAS Registry Number: 84-65-1
Synonyms: ANTHRAQUINONE, 9,10-Anthracenedione, Anthradione, Hoelite, Morkit, 9,10-Anthraquinone, Anthrapel, Corbit, Anthracenedione, Anthrachinon, Anthracenequinone, 9,10-Dioxoanthracene, Anthra-9,10-quinone, Caswell No. 052A, 9,10-Anthrachinon, 9,10-Anthracendion, Spectrum_001527, Anthraquinone [BSI:ISO], anthracene-9,10-dione, SpecPlus_000645

Molecular Formula: C14H8O2Molecular Weight: 208.212120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RZVHIXYEVGDQDX-UHFFFAOYSA-N

• ANTHRAQUINONE-2-CARBOXYLIC ACID
IUPAC Name: 9,10-dioxoanthracene-2-carboxylic acid | CAS Registry Number: 117-78-2
Synonyms: 2-Carboxyanthraquinone, Anthraquinone-2-carboxylic acid, 2-Anthraquinonecarboxylic acid, Anthraquinone-2-carboxylate, 2-Carboxyl-9,10-anthraquinone, 252727_ALDRICH, beta-Anthraquinonecarboxylic acid, Anthraquinone-.beta.-carboxylic acid, NSC5001, AIDS001371, .beta.-Anthraquinonecarboxylic acid, AIDS-001371, NSC 5001, EINECS 204-207-9, 9,10-Dioxoanthracene-2-carboxylic acid, 9,10-Anthraquinone 2-carboxylic acid, 2-Anthroic acid, 9,10-dihydro-9,10-dioxo-, AE-641/00185012, 2-Anthroic acid, 9,10-dihydro-9,10-dioxo- (8CI), 9,10-Dihydro-9,10-dioxo-2-anthracenecarboxylic acid

Molecular Formula: C15H8O4Molecular Weight: 252.221620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ASDLSKCKYGVMAI-UHFFFAOYSA-N

• Anthrone
IUPAC Name: 10H-anthracen-9-one | CAS Registry Number: 90-44-8
Synonyms: Carbothrone, Anthranone, ANTHRONE, 9(10H)-Anthracenone, 9-Oxoanthracene, 10H-anthracen-9-one, Ambap1438, anthracen-9(10H)-one, 9,10-Dihydro-9-oxoanthracene, CCRIS 3175, HSDB 2158, Anthracene, 9,10-dihydro-9-oxo-, A1631_SIAL, NSC 1965, 10740_FLUKA, CHEBI:33835, EINECS 201-994-0, NSC1965, 319899_SIAL, ZINC01017610

Molecular Formula: C14H10OMolecular Weight: 194.228600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RJGDLRCDCYRQOQ-UHFFFAOYSA-N

• Antiarol
IUPAC Name: 3,4,5-trimethoxyphenol | CAS Registry Number: 642-71-7
Synonyms: 3,4,5-Trimethoxyphenol, Spectrum_000525, SpecPlus_000623, Phenol, 3,4,5-trimethoxy-, Spectrum3_001208, Spectrum4_001487, Spectrum5_000193, BSPBio_002596, KBioGR_002093, KBioSS_001005, SPECTRUM200110, DivK1c_006719, CHEBI:2760, KBio1_001663, KBio2_001005, KBio2_003573, KBio2_006141, KBio3_002096, 3,4,5-TRIMETHOXY PHENOL, CID69505

Molecular Formula: C9H12O4Molecular Weight: 184.189180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VTCDZPUMZAZMSB-UHFFFAOYSA-N

• Antide
Synonyms: Iturelix, Nal-Lys-GnRH, Iturelix (USAN/INN), Orf 23541, Orf-23541, BRN 4866881, LS-15704, D04644, D-Alaninamide, N-acetyl-3-(2-naphthalenyl)-D-alanyl-4-chloro-D-phenylalanyl-3-(3-pyridinyl)-D-alanyl-L-seryl-N(sup 6)-(3-pyridinylcarbonyl)-L-lysyl-N(sup 6)-(3-pyridinylcarbonyl)-D-lysyl-L-leucyl-N(sup 6)-(1-methylethyl)-L-lysyl-L-prolyl-, D-Alaninamide, N-acetyl-3-(2-naphthalenyl)-D-alanyl-4-chloro-D-phenylalanyl-3-(3-pyridinyl)-D-alanyl-L-seryl-N6-(3-pyridinylcarbonyl)-L-lysyl-N6-(3-pyridinylcarbonyl)-D-lysyl-L-leucyl-N6-(1-methylethyl)-L-lysyl-L-prolyl-, (N-Acetyl-3-(naphhalen-2-yl)-D-alanyl)-p-chloro-D-phenylalanyl-3-(3-pyridyl)-D-alanyl-L-seryl-N(sup 6)-nicotinyl-L-lysyl-N(sup 6)-nicotinyl-D-lysyl-L-leucyl-N(sup 6)-isopropyl-L-lysyl-L-prolyl-D-alaninamide, D-Alaninamide, N-acetyl-3-(naphthalenyl)-D-alanyl-4-chloro-D-phenylalanyl-3-(3-pyridinyl)-D-alanyl-L-seryl-N(sup 6)-3-pyridinylcarbonyl)-L-lysyl-N(sup 6)-(3-pyridinylcarbonyl)-D-lysyl-L-leucyl-N(sup 6)-(1-methylethyl)-L-lysyl-L-prolyl-

Molecular Formula: C82H108ClN17O14Molecular Weight: 1591.293420 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 18

InChIKey: QRYFGTULTGLGHU-NBERXCRTSA-N


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