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• 2,3-Dichloro-5,6-Dicyano-1,4-Benzoquinone
IUPAC Name: 4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile | CAS Registry Number: 84-58-2
Synonyms: Dichlorodicyanoquinone, Dichlorodicyano-p-benzoquinone, Dichlorodicyanobenzoquinone, 2,3-Dichloro-5,6-dicyanoquinone, CCRIS 7154, D60400_ALDRICH, 1,2-Dichloro-4,5-dicyanobenzoquinone, 2,3-Dichloro-5,6-dicyanobenzoquinone, 2,3-Dicyano-5,6-dichlorobenzoquinone, 2,3,5,6-Dichlorodicyanoquinone, EINECS 201-542-2, 2,3-Dichloro-5,6-dicyano-p-quinone, AIDS218263, 2,3-Dichloro-5,6-dicyano-p-benzoquinone, NSC 401087, AIDS-218263, NSC401087, 5,6-Dichloro-2,3-dicyano-p-benzoquinone, 5,6-Dicyano-2,3-dichloro-p-benzoquinone, 1,4-CYCLOHEXADIENE-1,2-DICARBONITRILE, 4,5-DICHLORO-3,6-DIOXO-

Molecular Formula: C8Cl2N2O2Molecular Weight: 227.003800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HZNVUJQVZSTENZ-UHFFFAOYSA-N

• 1,1-diphenylpentane
IUPAC Name: 1-phenylpentylbenzene | CAS Registry Number: 1726-12-1
Synonyms: 1,1-Diphenylpentane, Benzene, 1,1'-pentylidenebis-, ST5407378

Molecular Formula: C17H20Molecular Weight: 224.340700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GSGNVNZDHCKRGI-UHFFFAOYSA-N

• 2-Amino Diphenyl Ether
IUPAC Name: 2-(phenoxy)aniline | CAS Registry Number: 2688-84-8
Synonyms: 2-Phenoxyaniline, o-Phenoxyaniline, 2-Aminodiphenyl ether, Aniline, 2-phenoxy-, 2-Phenoxybenzenamine, 2-Ade, Aniline, o-phenoxy-, o-Aminophenyl phenyl ether, 2-Aminophenyl phenyl ether, Benzenamine, 2-phenoxy-, Enamine_002073, Oprea1_152575, Aniline, o-phenoxy- (8CI), 346683_ALDRICH, EINECS 220-254-8, NSC 39655, CID75899, NSC39655, BRN 0777766, ZINC00389666

Molecular Formula: C12H11NOMolecular Weight: 185.221840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NMFFUUFPJJOWHK-UHFFFAOYSA-N

• 2,3-Dimethoxy Cinnamic Acid
IUPAC Name: (E)-3-(2,3-dimethoxyphenyl)prop-2-enoic acid | CAS Registry Number: 7461-60-1
Synonyms: 2,3-Dimethoxycinnamic acid, 2',3'-Dimethoxycinnamic acid, 275484_ALDRICH, trans-2,3-Dimethoxycinnamic acid, ALBB-006208, EINECS 231-249-5, (2E)-3-(2,3-dimethoxyphenyl)acrylic acid, ST5137726, (2E)-3-(2,3-Dimethoxyphenyl)-2-propenoic acid, 2-Propenoic acid, 3-(2,3-dimethoxyphenyl)-, 2-Propenoic acid, 3-(2,3-dimethoxyphenyl)-, (E)-, 7345-82-6, InChI=1/C11H12O4/c1-14-9-5-3-4-8(11(9)15-2)6-7-10(12)13/h3-7H,1-2H3,(H,12,13)/b7-6

Molecular Formula: C11H12O4Molecular Weight: 208.210580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QAXPUWGAGVERSJ-VOTSOKGWSA-N

• (+/-)-Alpha-Amino-3-Hydroxy-5-Methylisoxazole-4-Propionic Acid Hydrobromide
IUPAC Name: 2-amino-3-(5-methyl-3-oxo-1,2-oxazol-4-yl)propanoic acid hydrobromide | CAS Registry Number: 118896-96-1
Synonyms: ampa, (?)-AMPA hydrobromide, OR1155T, CID11957558, EU-0100581, NCGC00093962-01, (+/-)-alpha-AMINO-3-HYDROXY-5-METHYL-ISOXAZOLE-4-PROPIONIC ACID

Molecular Formula: C7H11BrN2O4Molecular Weight: 267.077240 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: KUAHVIUZGLGASU-UHFFFAOYSA-N

• 1-(Mesitylene-2-sulfonyl)-3-nitro-1H-1,2,4-triazole
IUPAC Name: 3-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-1,2,4-triazole | CAS Registry Number: 74257-00-4
Synonyms: MSNT, Oprea1_756023, ZINC00115199, 241784_SIAL, CID716901, SBB005917, 1-(2-Mesitylenesulfonyl)-3-nitro-1H-1,2,4-triazole, (2,4,6-Trimethylphenyl) (3-nitro-1,2,4-triazol-1-yl) sulfone

Molecular Formula: C11H12N4O4SMolecular Weight: 296.302380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: SFYDWLYPIXHPML-UHFFFAOYSA-N

• 2-Bromoethyl Acetate
IUPAC Name: 2-bromoethyl acetate | CAS Registry Number: 927-68-4
Synonyms: Bromoethyl acetate, 2-Bromoethylacetate, Ethanol, 2-bromo-, acetate, 1-Acetoxy-2-bromoethane, 1-Bromo-2-acetoxyethane, 2-BROMOETHYL ACETATE, 137685_ALDRICH, NSC 7079, 45857_FLUKA, EINECS 213-159-8, NSC7079, CID13564, BRN 1743110, ZINC01566591, NCGC00166119-01, LS-66506, 4-02-00-00136 (Beilstein Handbook Reference)

Molecular Formula: C4H7BrO2Molecular Weight: 167.001180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RGHQKFQZGLKBCF-UHFFFAOYSA-N

• 1,3-Dimethyl-2-imidazolidinone
IUPAC Name: 1,3-dimethylimidazolidin-2-one | CAS Registry Number: 80-73-9
Synonyms: Karbomos TsEM, Rhonite 1, Dimethylethyleneurea, Dimethyl imidazolidinone, N,N'-Dimethylethyleneurea, DMEU, 1,3-Dimethylethyleneurea, N,N'-Dimethylimidazolidone, N,N'-Dimethylimidazolidinone, 1,3-Dimethylimidazolidin-2-one, 1,3-Dimethyl-2-imidazolidone, 2-IMIDAZOLIDINONE, 1,3-DIMETHYL-, 193453_ALDRICH, 40725_FLUKA, 40727_FLUKA, EINECS 201-304-8, CID6661, BRN 0108808, SBB008346, 2-IMIDAZOLIDONE,1,3-DIMETHYL

Molecular Formula: C5H10N2OMolecular Weight: 114.145700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CYSGHNMQYZDMIA-UHFFFAOYSA-N

• 2,4-Dichlorobenzaldehyde
IUPAC Name: 2,4-dichlorobenzaldehyde | CAS Registry Number: 874-42-0
Synonyms: 2,4-DICHLOROBENZALDEHYDE, Benzaldehyde, 2,4-dichloro-, CCRIS 6013, 146757_ALDRICH, NSC 8762, 35250_FLUKA, EINECS 212-861-1, NSC8762, ZINC00478344, AI3-16063, LS-1876, NCGC00091704-01, ST5213382, AH-034/32850055, InChI=1/C7H4Cl2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YSFBEAASFUWWHU-UHFFFAOYSA-N

• 1,1-diphenylpropane
IUPAC Name: 1-phenylpropylbenzene | CAS Registry Number: 1530-03-6
Synonyms: Diphenylpropane, 1,1-DIPHENYLPROPANE, Benzene, 1,1'-propylidenebis-, EINECS 216-222-8, EINECS 246-696-1, ST5408036, 25167-94-6

Molecular Formula: C15H16Molecular Weight: 196.287540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BUZMJVBOGDBMGI-UHFFFAOYSA-N

• 1-Hydroxyadamantane
IUPAC Name: adamantan-1-ol | CAS Registry Number: 768-95-6
Synonyms: 1-Adamantanol, 1-Adamantol, Adamantan-1-ol, Ambap2129, 130346_ALDRICH, 54191_FLUKA, EINECS 212-202-8, NSC 91633, NSC 108837, Tricyclo(3.3.1.13,7)decan-1-ol, NSC91633, NSC108837, ZINC01297856, Tricyclo[3.3.1.1(3,7)]decan-1-ol, AI3-61285, SDCCGMLS-0066229.P001, Tricyclo[3.3.1.13,7]decan-1-ol, LS-15042, tricyclo[3.3.1.1~3,7~]decan-1-ol, ST5182315

Molecular Formula: C10H16OMolecular Weight: 152.233440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VLLNJDMHDJRNFK-UHFFFAOYSA-N

• (R)-(-)-1,1'-Bi(2-naphthyl) -2,2-diyl hydrogen phosphate [(R)-BNP Acid]
Synonyms: ZINC01765619, CID6995688

Molecular Formula: C20H12O4P-Molecular Weight: 347.280641 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JEHUZVBIUCAMRZ-UHFFFAOYSA-M

• 1,8-Diamino Naphthalene
IUPAC Name: naphthalene-1,8-diamine | CAS Registry Number: 479-27-6
Synonyms: 1,8-Naphthalenediamine, Naphthalene-1,8-diamine, 1,8-Diaminonaphthalene, 1,8-Naphthylenediamine, D21405_ALDRICH, NSC 6081, 33170_FLUKA, 33180_FLUKA, EINECS 207-529-8, NSC6081, ZINC00388487, 1,8-NAPHTHYLENEDIAMINE, TECH, AI3-03804, LS-167531, InChI=1/C10H10N2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6H,11-12H

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YFOOEYJGMMJJLS-UHFFFAOYSA-N

• (-)-Sparteine
Synonyms: Sparteine, lupinidine, Lupinidin, Spartein, (-)-Lupinidine, L-SPARTEINE, Prestwick_426, Sparteine (-), Prestwick3_000618, Sparteine (6CI,8CI), BSPBio_000556, MLS000028889, BPBio1_000612, CHEBI:28827, 6beta,7alpha,9alpha,11alpha-Pachycarpine, NCGC00142614-01, SMR000059203, TL8005816, 6-beta,7-alpha,9-alpha,11-alpha-Pachycarpine, C10783

Molecular Formula: C15H26N2Molecular Weight: 234.380340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SLRCCWJSBJZJBV-ZQDZILKHSA-N

• 2,4-Dichlorobenzoic Acid
IUPAC Name: 2,4-dichlorobenzoic acid | CAS Registry Number: 50-84-0
Synonyms: 2,4-DICHLOROBENZOIC ACID, Benzoic acid, 2,4-dichloro-, 2,4-Dichlorobenzoate, WLN: QVR BG DG, NSC 578, 139572_ALDRICH, 36749_RIEDEL, NSC578, 35300_FLUKA, CHEBI:30748, EINECS 200-067-8, AIDS018019, AIDS-018019, BRN 1868192, LS-146, AI3-14873, NCGC00091214-01, TL806117, ST5213899, C06670

Molecular Formula: C7H4Cl2O2Molecular Weight: 191.011460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ATCRIUVQKHMXSH-UHFFFAOYSA-N

• 1-Bromododecane
IUPAC Name: 1-bromododecane | CAS Registry Number: 143-15-7
Synonyms: Dodecyl bromide, n-Dodecyl bromide, Lauryl bromide, Dodecane, 1-bromo-, 1-BROMO-N-DODECANE, B65551_ALDRICH, 16970_FLUKA, 17743_FLUKA, CID8919, NSC6786, NSC 6786, EINECS 205-587-9, AI3-02166

Molecular Formula: C12H25BrMolecular Weight: 249.230900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PBLNBZIONSLZBU-UHFFFAOYSA-N

• 1-Indanone
IUPAC Name: 2,3-dihydroinden-1-one | CAS Registry Number: 83-33-0
Synonyms: Hydrindone, INDANONE, alpha-Hydrindone, Indan-1-one, alpha-Indanone, Indacrinone, Indacrinic acid, 1-Indone, .alpha.-Indanone, Indanone (VAN), .alpha.-Hydrindone, Indenone, dihydro-, indanone, sodium salt, indanone, (R)-isomer, indanone, (S)-isomer, 1H-Inden-1-one, 2,3-dihydro-, 1-HYDRINDONE, 2,3-Dihydro-1H-inden-1-one, indanone, (+-)-isomer, I2304_ALDRICH

Molecular Formula: C9H8OMolecular Weight: 132.159220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QNXSIUBBGPHDDE-UHFFFAOYSA-N

• 10,12-pentacosadiynoic Acid
IUPAC Name: pentacosa-10,12-diynoic acid | CAS Registry Number: 66990-32-7
Synonyms: 10,12-Pentacosadiynoic acid, pentacosa-10,12-diynoic acid, SBB009109, AC1LBMHY, ACMC-209nx9, AC1Q5W7A, 10,12-Pentacosadiynoicacid, 10-12-Pentacosadiynoic acid, 76492_ALDRICH, 76492_FLUKA, CTK2F2369, MolPort-003-938-981, ANW-35275, AR-1C0049, AKOS001016092, AG-G-53013, MCULE-8775174660, AK117005, DA3261;Pentacosa-10,12-diynoic acid;, KB-259207

Molecular Formula: C25H42O2Molecular Weight: 374.599780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZPUDRBWHCWYMQS-UHFFFAOYSA-N

• 1 5-Dibromo Pentane
IUPAC Name: 1,5-dibromopentane | CAS Registry Number: 111-24-0
Synonyms: Pentamethylene bromide, Pentane, 1,5-dibromo-, 1,5-DIBROMOPENTANE, Pentamethylene dibromide, 128007_ALDRICH, NSC 5373, EINECS 203-849-7, CID8100, NSC5373, BRN 1209245, AI3-20307, LS-101616, 4-01-00-00314 (Beilstein Handbook Reference), InChI=1/C5H10Br2/c6-4-2-1-3-5-7/h1-5H

Molecular Formula: C5H10Br2Molecular Weight: 229.940900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IBODDUNKEPPBKW-UHFFFAOYSA-N

• (R)-(-)-2-(tertButoxycarbonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
IUPAC Name: (3R)-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate | CAS Registry Number: 115962-35-1
Synonyms: ZINC00057554, ZINC04208809, CID7129828

Molecular Formula: C15H18NO4-Molecular Weight: 276.307720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HFPVZPNLMJDJFB-GFCCVEGCSA-M

• 1,1'-Diacetylferrocene
IUPAC Name: 1-cyclopenta-2,4-dien-1-ylideneethanolate; iron | CAS Registry Number: 1273-94-5
Synonyms: 1,1'-DIACETYL FERROCENE

Molecular Formula: C14H14FeO2-2Molecular Weight: 270.104760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XTOCKTMXVGANAH-UHFFFAOYSA-L

• 1,3-Propanedithiol
IUPAC Name: propane-1,3-dithiol | CAS Registry Number: 109-80-8
Synonyms: Trimethylenedithiol, Dithiotrimethyleneglycol, Trimethylene dimercaptan, Dithiol deriv., Propane-1,3-dithiol, Trimethylenedithioglycol, 1,3-Propanedimercaptan, 1,3-DIMERCAPTOPROPANE, FEMA No. 3588, P50609_ALDRICH, W358800_ALDRICH, NDR-132, CHEBI:44864, EINECS 203-706-9, CID8013, AIDS081871, AIDS-081871, BRN 1071197, ZINC03860693, LS-120787

Molecular Formula: C3H8S2Molecular Weight: 108.225620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZJLMKPKYJBQJNH-UHFFFAOYSA-N

• 2-Bromothiophene
IUPAC Name: 2-bromothiophene | CAS Registry Number: 1003-09-4
Synonyms: 2-BROMOTHIOPHENE, Thiophene, 2-bromo-, 2-Thienyl bromide, sFpDAbHHRYSZZP@, 124168_ALDRICH, NSC4456, NSC 4456, EINECS 213-699-4, SBB003931, ZINC01673392, TL8000043, H23029, InChI=1/C4H3BrS/c5-4-2-1-3-6-4/h1-3

Molecular Formula: C4H3BrSMolecular Weight: 163.035620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: TUCRZHGAIRVWTI-UHFFFAOYSA-N

• 2-Naphthoxy Acetic Acid
IUPAC Name: 2-naphthalen-2-yloxyacetic acid | CAS Registry Number: 120-23-0
Synonyms: Bnoa, Betoxon, Betapal, 2-Naphthoxyacetic acid, 2-Noxa, NOXA, Phyomone, (2-Naphthyloxy)acetic acid, Gerlach 1396, 2-Naphthyloxyacetic acid, Naphthoxyacetic acid, beta-Naphthyloxyacetic acid, (2-Naphthloxy)acetic acid, O-(2-Naphthyl)glycolic acid, Acetic acid, (2-naphthyloxy)-, 2-Naphthalenoxyacetic acid, Acetic acid, (2-naphthalenyloxy)-, (2-Naphthalenyloxy)acetic acid, NAPHTHYLOXYACETIC ACID, (2-Naphthoxy)acetic acid

Molecular Formula: C12H10O3Molecular Weight: 202.206000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RZCJYMOBWVJQGV-UHFFFAOYSA-N

• 2-Aminothiophenol
IUPAC Name: 2-aminobenzenethiol | CAS Registry Number: 137-07-5
Synonyms: o-Mercaptoaniline, 2-Mercaptoaniline, o-Aminothiophenol, 2-Mercaptaniline, o-Aminobenzenethiol, Benzenethiol, 2-amino-, 2-AMINOBENZENETHIOL, Benzenethiol, o-amino-, 2-Amino thiophenol, 1-Amino-2-mercaptobenzene, o-Aminophenyl mercaptan, 2-Aminophenyl mercaptan, USAF EK-4376, WLN: ZR BSH, 123137_ALDRICH, 274240_ALDRICH, CCRIS 9096, NSC 4738, EINECS 205-277-3, CID8713

Molecular Formula: C6H7NSMolecular Weight: 125.191480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VRVRGVPWCUEOGV-UHFFFAOYSA-N

• 1-pentyne
IUPAC Name: pent-1-yne | CAS Registry Number: 627-19-0
Synonyms: 1-PENTYNE, Acetylene, propyl-, pent-1-yne, 256560_ALDRICH, 77050_FLUKA, EINECS 210-987-1, AI3-37709, TL8004247, InChI=1/C5H8/c1-3-5-4-2/h1H,4-5H2,2H

Molecular Formula: C5H8Molecular Weight: 68.117020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IBXNCJKFFQIKKY-UHFFFAOYSA-N

• 1,3-CyclohexaneDione
IUPAC Name: cyclohexane-1,3-dione | CAS Registry Number: 504-02-9
Synonyms: Dihydroresorcinol, 1,3-Cyclohexanedione, Hydroresorcinol, 1,3-Cyclohexanone, Resorcinol, dihydro-, 1,3-Cyclohexandione, 1,3 Cyclohexanedione, CYCLOHEXANE-1,3-DIONE, 1,3-Benzenediol, dihydro-, WLN: L6V CVTJ, Benzil-related compound, 49, CYCLOHEXANE-13-DIONE, C101605_ALDRICH, 29059_FLUKA, CHEBI:17766, CID10434, NSC57477, EINECS 207-980-0, NSC 57477, SB 01019

Molecular Formula: C6H8O2Molecular Weight: 112.126520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HJSLFCCWAKVHIW-UHFFFAOYSA-N

• 1,1,3,3-Tetraethoxypropane
IUPAC Name: 1,1,3,3-tetraethoxypropane | CAS Registry Number: 122-31-6
Synonyms: Tetraethoxypropane, Tetraethoxy propane, Malonaldehyde diethyl acetal, USAF KF-26, Malonaldehyde, bis(diethyl acetal), Propane, 1,1,3,3-tetraethoxy-, Malonaldehyde tetraethyl acetal, Malonaldehyde bis(diethyl acetal), Malondialdehyde tetraethylacetal, Malonaldehyde tetraethyl diacetal, Tetraethyl malondialdehyde acetal, T9889_SIGMA, STOCK4S-20602, 86570_FLUKA, EINECS 204-533-1, NSC 17068, NSC17068, BRN 1209619, MALONALDEHYDE TETRAETHYLACETAL, ZINC01747949

Molecular Formula: C11H24O4Molecular Weight: 220.305860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: KVJHGPAAOUGYJX-UHFFFAOYSA-N

• 1-AdamantaneCarboxylic acid
IUPAC Name: adamantane-1-carboxylic acid | CAS Registry Number: 828-51-3
Synonyms: Adamantoic acid, 1-Carboxyadamantane, 1-Adamantanecarboxylic acid, Adamantanecarboxylic acid, Adamantane-1-carboxylic acid, Enamine_000586, Adamantane-2-carboxylic acid, Oprea1_849468, 106399_ALDRICH, 3-ADAMANTANECARBOXYLIC ACID, 01823_FLUKA, EINECS 212-584-6, NSC 94182, 1-Adamantanecarboxylic acid (8CI), CID13235, NSC94182, SBB015170, AI3-52431, LS-14967, Tricyclo(3.3.1.1'3,7)decane-1-carboxylic acid

Molecular Formula: C11H16O2Molecular Weight: 180.243540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JIMXXGFJRDUSRO-UHFFFAOYSA-N

• 2,3,5-Trichlorobenzaldehyde
IUPAC Name: 2,3,5-trichlorobenzaldehyde | CAS Registry Number: 56961-75-2
Synonyms: Benzaldehyde, 2,3,5-trichloro-, 292338_ALDRICH, SBB003454, ZINC02539407

Molecular Formula: C7H3Cl3OMolecular Weight: 209.457120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DJYRZTCLVDKWBL-UHFFFAOYSA-N

• 2,4-Dinitrofluorobenzene
IUPAC Name: 1-fluoro-2,4-dinitrobenzene | CAS Registry Number: 70-34-8
Synonyms: Dinitrofluorobenzene, DNFB, FDNB, Sanger reagent, Fluorodinitrobenzene, Sanger's Reagent, 1-FLUORO-2,4-DINITROBENZENE, DNPF, Benzene, 1-fluoro-2,4-dinitro-, Fluoro-2,4-dinitrobenzene, 2,4-Dinitrobenzenefluoride, 2,4-Dinitro-1-fluorobenzene, 2,4-Dinitrophenyl fluoride, DFB (VAN), Fluorodinitrobenzene (VAN), WLN: WNR BF ENW, 2,4-Dinitrobenzene fluoride, 2,4-DNFB, CCRIS 1800, 1,2,4-Fluorodinitrobenzene

Molecular Formula: C6H3FN2O4Molecular Weight: 186.097423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: LOTKRQAVGJMPNV-UHFFFAOYSA-N

• 1,2-Octanediol
IUPAC Name: octane-1,2-diol | CAS Registry Number: 1117-86-8
Synonyms: 1,2-Dihydroxyoctane, 1,2-OCTANEDIOL, 1,2-Octylene glycol, octane-1,2-diol, NCIOpen2_000498, 213705_ALDRICH, CHEBI:34056, AIDS017556, AIDS-017556, NSC71546, EINECS 214-254-7, NSC 71546, AI3-13058, C14273, 87720-89-6

Molecular Formula: C8H18O2Molecular Weight: 146.227320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: AEIJTFQOBWATKX-UHFFFAOYSA-N

• 12-Aminododecanoic Acid
IUPAC Name: 12-aminododecanoic acid | CAS Registry Number: 693-57-2
Synonyms: 12-Aminolauric acid, 12-Aminododecanoic acid, .omega.-Aminolauric acid, Omega-Aminododecanoic acid, CCRIS 6171, 12-AMINO-DODECANOIC ACID, 159247_ALDRICH, EINECS 211-754-7, LMFA01100005, LS-181682, TL8006598, DOA, 95418-77-2

Molecular Formula: C12H25NO2Molecular Weight: 215.332400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PBLZLIFKVPJDCO-UHFFFAOYSA-N

• 2-bromopropene
IUPAC Name: 2-bromoprop-1-ene | CAS Registry Number: 557-93-7
Synonyms: Isopropenyl bromide, 2-Bromopropylene, Propene, 2-bromo-, 2-BROMOPROPENE, 2-Bromo-1-propene, Isopropylene bromide, 1-Propene, 2-bromo-, 2-bromoprop-1-ene, alpha-Methylvinyl bromide, .alpha.-Methylvinyl bromide, B78254_ALDRICH, EINECS 209-185-4, NSC 87535, CID11202, NSC87535, BRN 1731926, LS-123450, InChI=1/C3H5Br/c1-3(2)4/h1H2,2H, 4-01-00-00754 (Beilstein Handbook Reference)

Molecular Formula: C3H5BrMolecular Weight: 120.975800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PHMRPWPDDRGGGF-UHFFFAOYSA-N

• 1,2,3-Trimethoxy Benzene
IUPAC Name: 1,2,3-trimethoxybenzene | CAS Registry Number: 634-36-6
Synonyms: Methylsyringol, Tri-O-methylpyrogallol, Pyrogallol trimethyl ether, 1,2,3-TRIMETHOXYBENZENE, Methylsyringol (VAN), Benzene, 1,2,3-trimethoxy-, 137995_ALDRICH, 92159_FLUKA, CID12462, NSC10124, EINECS 211-207-2, NSC 10124, ZINC00152503, AI3-02077, ST5406631, TL8004419

Molecular Formula: C9H12O3Molecular Weight: 168.189780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CRUILBNAQILVHZ-UHFFFAOYSA-N

• 1-Aminopyrene
IUPAC Name: pyren-1-amine | CAS Registry Number: 1606-67-3
Synonyms: 3-Aminopyrene, 1-PYRENAMINE, Pyrene, amino-, alpha-Aminopyrene, Pyren-1-ylamine, pyren-1-amine, N-1-AMINOPYRENE, CCRIS 760, A77903_ALDRICH, EINECS 216-521-3, NSC 11436, NSC11436, BRN 1875737, SBB003375, ZINC01504382, WLN: L666 B6 2AB PJ GZ, LS-129419, TL8001220, 4-12-00-03464 (Beilstein Handbook Reference), C004482

Molecular Formula: C16H11NMolecular Weight: 217.265240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YZVWKHVRBDQPMQ-UHFFFAOYSA-N

• 1,1'-Ferrocenedicarboxylic Acid
IUPAC Name: cyclopentanecarboxylic acid; iron | CAS Registry Number: 1293-87-4
Synonyms: 1-1'-FERROCENEDICARBOXYLIC ACID

Molecular Formula: C12H20FeO4Molecular Weight: 284.129800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: TVIVBANEEXZBHJ-UHFFFAOYSA-N

• 10-Undecynoic Acid
IUPAC Name: undec-10-ynoic acid | CAS Registry Number: 2777-65-3
Synonyms: 10-Undecynoic acid, Hendecynoic acid, Undec-10-ynoic acid, 10-HENDECYNOIC ACID, 406546_ALDRICH, EINECS 220-471-8, C11H18O2, CID31039, BRN 1704918, LMFA01030618, SBB008483, FR-2153, LS-158495, 4-02-00-01738 (Beilstein Handbook Reference), 22202-65-9

Molecular Formula: C11H18O2Molecular Weight: 182.259420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OAOUTNMJEFWJPO-UHFFFAOYSA-N

• 2-Chloroanthraquinone
IUPAC Name: 2-chloroanthracene-9,10-dione | CAS Registry Number: 131-09-9
Synonyms: Anthraquinone, 2-chloro-, 2-CHLOROANTHRAQUINONE, beta-Chloroanthraquinone, 9,10-Anthracenedione, 2-chloro-, 2-Chloro-9,10-anthraquinone, .beta.-Chloroanthraquinone, 2-Chloroanthra-9,10-quinone, 2-Chloro-9,10-anthracenedione, 156299_ALDRICH, NSC 1702, EINECS 205-010-0, NSC1702, AIDS017894, AIDS-017894, ZINC03861197, AI3-00064, LS-20648, InChI=1/C14H7ClO2/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7

Molecular Formula: C14H7ClO2Molecular Weight: 242.657180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FPKCTSIVDAWGFA-UHFFFAOYSA-N

• 2,4,5-Trichlorophenol
IUPAC Name: 2,4,5-trichlorophenol | CAS Registry Number: 95-95-4
Synonyms: Dowicide 2, Collunosol, Nurelle, Preventol I, 2,4,5-TRICHLOROPHENOL, Phenol, 2,4,5-trichloro-, PS9_SUPELCO, RCRA waste no. U230, RCRA waste number U230, CCRIS 718, WLN: QR BG CG EG, HSDB 4067, 2,4,5-TCP, 156515_ALDRICH, 36513_RIEDEL, 442301_SUPELCO, NCI-C61187, NSC 2266, 91332_FLUKA, CHEBI:28520

Molecular Formula: C6H3Cl3OMolecular Weight: 197.446420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LHJGJYXLEPZJPM-UHFFFAOYSA-N

• 2-Bromo Propionic Acid
IUPAC Name: 2-bromopropanoic acid | CAS Registry Number: 598-72-1
Synonyms: 2-Bromopropanoic acid, Propanoic acid, 2-bromo-, 2-BROMOPROPIONIC ACID, Propionic acid, 2-bromo-, alpha-Bromopropionic acid, .alpha.-Bromopropionic acid, WLN: QVYE1, ()-2-Bromopropionic acid, NCIOpen2_009509, B78300_ALDRICH, NSC 172, (+/-)-2-Bromopropionic acid, 442337_SUPELCO, NSC172, 18170_FLUKA, EINECS 209-947-6, AI3-52314, Propionic acid, 2-bromo- (6CI,7CI,8CI), Propanoic acid, 2-bromo-, (.+/-.)-, LS-121233

Molecular Formula: C3H5BrO2Molecular Weight: 152.974600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MONMFXREYOKQTI-UHFFFAOYSA-N

• 1,1,4,4-Tetraphenyl-1,3-Butadiene
IUPAC Name: 1,4,4-tri(phenyl)buta-1,3-dienylbenzene | CAS Registry Number: 1450-63-1
Synonyms: Tetraphenylbutadiene, 1,1,4,4-Tetraphenylbutadiene, 1,3-Butadiene, 1,1,4,4-tetraphenyl-, 185213_ALDRICH, EINECS 215-914-7, 1,1,4,4-Tetraphenyl-1,3-butadiene, 1,1,4,4-Tetraphenylbuta-1,3-diene, CID74060, NSC12572, BRN 1914229, STK053486, ZINC01724607, 1,1,4,4-Tetraphpenyl-1,3-butadiene, LS-29227, (1,4,4-Triphenyl-1,3-butadienyl)benzene, 1,1,4,4-TETRAPHENYLBUTADIENE, SCINT, Benzene, 1,1',1'',1'''-(1,3-butadiene-1,4-diylidene)tetrakis-, 4-05-00-02816 (Beilstein Handbook Reference), AB-016/30005011, 1,1',1'',1'''-(1,3-Butadiene-1,4-diylidene)tetrabenzene

Molecular Formula: C28H22Molecular Weight: 358.474280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KLCLIOISYBHYDZ-UHFFFAOYSA-N

• 1-(3-Chlorophenyl) Piperazine HCl
IUPAC Name: 1-(3-chlorophenyl)piperazine hydrochloride | CAS Registry Number: 65369-76-8
Synonyms: m-CPP, C10H13ClN2.HCl, MLS001332529, MLS001332530, MLS002153364, 1-(3-Chlorophenyl)piperazine hydrochloride, 125180_ALDRICH, EINECS 235-976-9, 1-(3-Chlorophenyl)piperazinium chloride, EINECS 257-333-1, EINECS 265-718-0, NSC134746, SBB003261, SMR000875230, 1-(3-Chlorophenyl)piperazine monohydrochloride, Piperazine, 1-(3-chlorophenyl)-, monohydrochloride, LS-111322, TL8004644, 1-(3-Chlorophenyl)piperazine dihydrochloride, 1-(M-CHLOROPHENYL)PIPERAZINE HYDROCHLORIDE

Molecular Formula: C10H14Cl2N2Molecular Weight: 233.137560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MHXPYWFZULXYHT-UHFFFAOYSA-N

• 2-Aminoanthracene
IUPAC Name: anthracen-2-amine | CAS Registry Number: 613-13-8
Synonyms: 2-Anthramine, 2-Anthrylamine, 2-Anthracylamine, 2-ANTHRACENAMINE, 2-Anthracenamide, beta-Aminoanthracene, 1-Aminoanthracene, anthracen-2-amine, .beta.-Aminoanthracene, 2-Anthramine (8CI), CCRIS 22, A38800_ALDRICH, HSDB 4041, WLN: L C666J EZ, 06765_FLUKA, CHEBI:34260, EINECS 210-330-9, AIDS018997, NSC 400535, AIDS-018997

Molecular Formula: C14H11NMolecular Weight: 193.243840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YCSBALJAGZKWFF-UHFFFAOYSA-N

• 2,4-Dimethyl-5-Acetyl Thiazole
IUPAC Name: 1-(2,4-dimethyl-1,3-thiazol-5-yl)ethanone | CAS Registry Number: 38205-60-6
Synonyms: 2,4-dimethyl-5-acetylthiazole, 5-Acetyl-2,4-dimethylthiazole, W326704_ALDRICH, FEMA No. 3267, 298085_ALDRICH, EINECS 253-826-0, SBB006624, ZINC00159554, 2,4-Dimethyl-5-thiazoyl methyl ketone, 1-(2,4-Dimethyl-5-thiazolyl)ethanone, Ketone, 2,4-dimethyl-5-thiazolyl methyl, 1-(2,4-Dimethylthiazol-5-yl)ethan-1-one, Ethanone, 1-(2,4-dimethyl-5-thiazolyl)-

Molecular Formula: C7H9NOSMolecular Weight: 155.217460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BLQOKWQUTLNKON-UHFFFAOYSA-N

• 1,2,4-Butanetriol
IUPAC Name: butane-1,2,4-triol | CAS Registry Number: 3068-00-6
Synonyms: 2-Deoxyerythritol, 1,3,4-Butanetriol, Triol 124, 1,2,4-BUTANETRIOL, Butane-1,2,4-Triol, 1,2,4-Trihydroxybutane, ()-1,2,4-Butanetriol, 1,2,4-Butantriol [German], 19040_FLUKA, EINECS 221-323-5, NSC 60197, NSC60197, BRN 1733456, FR-0154, NCGC00166053-01, NCGC00166117-01, NCGC00166126-01, LS-46030, 2-01-00-00596 (Beilstein Handbook Reference), 6810-31-7

Molecular Formula: C4H10O3Molecular Weight: 106.120400 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: ARXKVVRQIIOZGF-UHFFFAOYSA-N

• 2,6-DCA
IUPAC Name: 2,6-dichloroaniline | CAS Registry Number: 608-31-1
Synonyms: 2,6-DICHLOROANILINE, 2,6-Dichloranilin, Benzenamine, 2,6-dichloro-, 2,6-dichlorobenzenamine, D55504_ALDRICH, 36703_RIEDEL, 35200_FLUKA, CHEBI:46630, EINECS 210-160-5, ZINC02567970, LS-28227, ST5406285, TL80073954, InChI=1/C6H5Cl2N/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H, 51225-19-5

Molecular Formula: C6H5Cl2NMolecular Weight: 162.016600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JDMFXJULNGEPOI-UHFFFAOYSA-N

• 2,3,5-Trimethylphenol
IUPAC Name: 2,3,5-trimethylphenol | CAS Registry Number: 697-82-5
Synonyms: Isopseudocumenol, Trimethylphenol, 2,3,5-TRIMETHYLPHENOL, Phenol, 2,3,5-trimethyl-, Ambap7241, 6-HYDROXYPSEUDOCUMENE, 1-Hydroxy-2,3,5-trimethylbenzene, T78603_ALDRICH, 34308_RIEDEL, 92690_FLUKA, CHEBI:38570, NSC5296, NSC 5296, EINECS 211-806-9, ZINC01235982, Phenol, 2,3,5(or 3,4,5)-trimethyl-, TL8004904, B10001, InChI=1/C9H12O/c1-6-4-7(2)8(3)9(10)5-6/h4-5,10H,1-3H, 70969-66-3

Molecular Formula: C9H12OMolecular Weight: 136.190980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: OGRAOKJKVGDSFR-UHFFFAOYSA-N

• 2,3-Dichloropropene
IUPAC Name: 2,3-dichloroprop-1-ene | CAS Registry Number: 78-88-6
Synonyms: 2,3-Dichloropropylene, Propene, 2,3-dichloro-, 2-Chloroallyl chloride, 1-Propene, 2,3-dichloro-, Propylene, 2,3-dichloro, 1,2-Dichloro-2-propene, 2,3-DICHLORO-1-PROPENE, 2,3-dichloroprop-1-ene, CCRIS 956, C3H4Cl2, WLN: G1YGU1, D72603_ALDRICH, HSDB 5222, 36318_FLUKA, EINECS 201-153-8, 2,3-DCP, NSC 60520, NSC60520, BRN 1361491, AI3-14619

Molecular Formula: C3H4Cl2Molecular Weight: 110.969860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FALCMQXTWHPRIH-UHFFFAOYSA-N

• 2-(trimethylsilyl)-1,3-thiazole
IUPAC Name: trimethyl(1,3-thiazol-2-yl)silane | CAS Registry Number: 79265-30-8
Synonyms: 2-(Trimethylsilyl)thiazole, 2-Trimethylsilylthiazole, 2-Thiazolyltrimethylsilane, 2-(Trimethylsilyl)-1,3-thiazole, trimethyl(1,3-thiazol-2-yl)silane, AG-H-18040, 2-TST, PubChem10262, ACMC-209pgq, AC1LBSY2, AMTSi029, SureCN344256, AC1Q29TX, trimethyl(2-thiazolyl)silane, KSC490O7F, 361410_ALDRICH, 2-TRIMETHYLSILANYLTHIAZOLE, 92785_FLUKA, CTK3J0772, MolPort-000-139-664

Molecular Formula: C6H11NSSiMolecular Weight: 157.308740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VJCHUDDPWPQOLH-UHFFFAOYSA-N


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