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2251 to 2300 of 4371 Products/Chemicals (Click for related suppliers)  Page: << Previous 50 Results 40 41 42 43 44 45 [46] 47 48 49 50 51 52 53 54 55 56 57 58 59 60 >> Next 50 Results
• 2,5-Difluoromandelic acid
IUPAC Name: 2-(2,5-difluorophenyl)-2-hydroxyacetic acid | CAS Registry Number: 207853-61-0
Synonyms: 2,5-difluoro mandelic acid, 2-(2,5-difluorophenyl)-2-hydroxyacetic acid, (2,5-Difluorophenyl)(hydroxy)acetic acid, AC1LBTCD, SureCN1668569, MolPort-000-154-368, SBB063936, AKOS009158212, MCULE-2533360656, AC-10453, KB-105312, FT-0610361, FT-0652897, ST50408068, A814894, I01-3404, I01-6693, 2-[2,5-bis(fluoranyl)phenyl]-2-oxidanyl-ethanoic acid

Molecular Formula: C8H6F2O3Molecular Weight: 188.128246 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PATKDMCCMCSATF-UHFFFAOYSA-N

• 4'-Chloro-3,4-dihydroxybenzophenone
IUPAC Name: (4-chlorophenyl)-(3,4-dihydroxyphenyl)methanone | CAS Registry Number: 134612-84-3
Synonyms: 4'-CHLORO-3,4-DIHYDROXYBENZOPHENONE, Methanone,(4-chlorophenyl)(3,4-dihydroxyphenyl)-, ACMC-20mvfd, PubChem7466, SureCN6746043, CHEMBL1171213, Ambap134612-84-3, CTK4B9296, MolPort-002-461-888, ZINC22005628, 4-chloro-3',4'-dihydroxybenzophenone, AKOS015914529, AG-D-70680, AK114628, KB-190639, (4-Chlorophenyl)(3,4-dihydroxyphenyl)methanone, (4-Chlorophenyl)(3,4-dihydroxyphenyl)methanone;, (4-chlorophenyl)-(3,4-dihydroxyphenyl)methanone, A806811, [3,4-bis(oxidanyl)phenyl]-(4-chlorophenyl)methanone

Molecular Formula: C13H9ClO3Molecular Weight: 248.661760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SYNNFRPIIUNOHK-UHFFFAOYSA-N

• 2,2-Difluoro-1,3-benzodioxole-4-carbonylchloride
IUPAC Name: 2,2-difluoro-1,3-benzodioxole-4-carbonyl chloride | CAS Registry Number: 143096-86-0
Synonyms: ZINC02382132, JRD-1191, CID2774062, 2,2-Difluoro-1,3-benzodioxole-4-carbonyl chloride

Molecular Formula: C8H3ClF2O3Molecular Weight: 220.557426 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: URZQSPHXJREUFT-UHFFFAOYSA-N

• 2-(Chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine
IUPAC Name: 2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine | CAS Registry Number: 117977-20-5
Synonyms: 2-Chloromethyl-4-(3-methoxypropoxy)-3-methylpyridin, Pyridine,2-(chloromethyl)-4-(3-methoxypropoxy)-3-methyl-, 2-Chloromethyl-4-(3-Methoxy Propoxy)-3-Methyl Pyridine, PubChem20770, ACMC-20ac10, SureCN1307697, CTK4B0527, MolPort-005-935-472, AC-714, ANW-66514, SBB070837, ZINC21298146, AKOS015891728, AG-D-40215, AK-41292, KB-170010, FT-0642882, I02-1925, 2-chloromethyl-4-(3-methoxypropoxy)-3-methylpyridine, 2-Chloromethyl-4-(3-methoxypropoxy)-3-methylpyridine Hydrochloride

Molecular Formula: C11H16ClNO2Molecular Weight: 229.703240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XPYNCLYLFSMFQE-UHFFFAOYSA-N

• 11alpha- Hydroxyandrost-4-ene-3,17-dione
IUPAC Name: 11-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 564-33-0
Synonyms: Oprea1_410438, NSC9720, Androst-4-ene-3,17-dione, 11.beta.-hydroxy-, Androst-4-ene-3,17-dione, 11-hydroxy-, (11.beta.)-

Molecular Formula: C19H26O3Molecular Weight: 302.407940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WSCUHXPGYUMQEX-UHFFFAOYSA-N

• 6-Methoxyuracil
IUPAC Name: 6-methoxy-1H-pyrimidine-2,4-dione | CAS Registry Number: 29458-38-6
Synonyms: 6-methoxypyrimidine-2,4(1H,3H)-dione, STK257420, ZINC00332734, AC1LGAMO, SureCN3109540, SureCN6435895, CTK4G3328, MolPort-002-988-228, 2,4-Dihydroxy-6-methoxypyrimidine, 6-methoxy-1H-pyrimidine-2,4-dione, AKOS005423780, AKOS006344243, AG-E-95943, MCULE-5375145256, RP20726, AC-17060, AK-26895, 2,4(1H,3H)-Pyrimidinedione,6-methoxy-, KB-249052, FT-0638855

Molecular Formula: C5H6N2O3Molecular Weight: 142.112740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SWNDNOHEVRPIDI-UHFFFAOYSA-N

• 1-Chlorononafluorobutane
IUPAC Name: 1-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutane | CAS Registry Number: 558-89-4
Synonyms: 1-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutane, AC1MC606, CTK5A4333, MolPort-001-777-086, PC7881, SBB101454, AKOS007930101, AG-F-95940, KB-152619, FT-0607653, 4-chloro-1,1,1,2,2,3,3,4,4-nonafluorobutane, A830849, 1-chloranyl-1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane

Molecular Formula: C4ClF9Molecular Weight: 254.481429 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 9

InChIKey: GIUDNRMHWCAPGM-UHFFFAOYSA-N

• 1H,1H,2H,2H-Heptadecafluorodecyl methacrylate
IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl 2-methylprop-2-enoate | CAS Registry Number: 1996-88-9
Synonyms: 474223_ALDRICH, EINECS 217-877-2, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl methacrylate, 119938-07-7, 123203-95-2, 128809-13-2, 140143-15-3, 162953-65-3, 2-Propenoic acid, 2-methyl-, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl ester, 203868-08-0

Molecular Formula: C14H9F17O2Molecular Weight: 532.192914 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 19

InChIKey: HBZFBSFGXQBQTB-UHFFFAOYSA-N

• 5-Nitrooxindole
IUPAC Name: 5-nitro-1,3-dihydroindol-2-one | CAS Registry Number: 20870-79-5
Synonyms: 5-Nitro-2-oxindole, NCIOpen2_002205, 653683_ALDRICH, 5-Nitro-1,3-dihydroindole-2-one, NSC25199, NSC99066, ZINC04368908, ST5411259

Molecular Formula: C8H6N2O3Molecular Weight: 178.144840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JQCGHRDKVZPCRO-UHFFFAOYSA-N

• 1-Butyl-2-thiourea
IUPAC Name: butylthiourea | CAS Registry Number: 1516-32-1
Synonyms: Butylthiourea, N-Butylthiourea, Thiourea, butyl-, n-Butyl thiourea, Butyl-2-thiourea, Urea, 1-butyl-2-thio-, USAF D-5, WLN: SUYZM4, EINECS 216-165-9, NSC 202953, BRN 1744779, NSC202953, ZINC01737392, LS-159284, ST5410288, 4-04-00-00584 (Beilstein Handbook Reference)

Molecular Formula: C5H12N2SMolecular Weight: 132.227180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: GMEGXJPUFRVCPX-UHFFFAOYSA-N

• (4-Methylphenylsulfonylamino)acetic Acid
IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid | CAS Registry Number: 1080-44-0
Synonyms: N-p-Tosylglycine, N-4-Tosylglycine, N-(p-Toluenesulfonyl)glycine, Oprea1_169137, CBDivE_003168, p-TOLUENESULFONYLGLYCINE, N-p-toluenesulfonyl-dl-glycine, 403458_ALDRICH, (p-Toluenesulfonamido)acetic acid, NSC25821, NSC 25821, SBB015188, Glycine, N-((4-methylphenyl)sulfonyl)-, Glycine, N-[(4-methylphenyl)sulfonyl]-, EU-0000679, ([(4-Methylphenyl)sulfonyl]amino)acetic acid

Molecular Formula: C9H11NO4SMolecular Weight: 229.252940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: VDKFCCZUCXYILI-UHFFFAOYSA-N

• 4-Amino-5-fluoroquinazoline
IUPAC Name: 5-fluoroquinazolin-4-amine | CAS Registry Number: 137553-48-1
Synonyms: 5-fluoroquinazolin-4-amine, 4-Amino-5-Fluoroquinazoline, 4-Quinazolinamine,5-fluoro-, AG-D-76297, ZINC00111767, AC1LEOBR, PubChem14473, ACMC-209wx1, 5-fluoro-4-quinazolinamine, AC1Q52XJ, SureCN2124702, 5-fluoroquinazolin-4-ylamine, 5-fluoranylquinazolin-4-amine, 5-fluoroquinazoline-4-ylamine, CTK4C0872, MolPort-000-151-083, HMS1668L14, ACT01950, ANW-46931, CCG-44808

Molecular Formula: C8H6FN3Molecular Weight: 163.151743 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KKLLTCMELJRTDI-UHFFFAOYSA-N

• 2-(Tribromomethanesulfonyl)pyridine
IUPAC Name: 2-(tribromomethylsulfonyl)pyridine | CAS Registry Number: 59626-33-4
Synonyms: 2-Pyridyl Tribromomethyl Sulfone, 2-((tribromomethyl)sulfonyl)pyridine, 2-(tribromomethylsulfonyl)pyridine, 2-Pyridyltribromomethylsulfone, 2-[(Tribromomethyl)sulfonyl]-pyridine, PubChem2591, ACMC-209met, SureCN542032, AGN-PC-006MFZ, CTK5B0219, MolPort-002-317-264, ANW-33315, ZINC06088327, 2-[(Tribromomethyl)sulfonyl]pyridine;, AKOS015833918, AC-4674, AG-G-12612, Pyridine,2-[(tribromomethyl)sulfonyl]-, Pyridine, 2-[(tribromomethyl)sulfonyl]-, AK109169

Molecular Formula: C6H4Br3NO2SMolecular Weight: 393.878460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FRCQMXHPNJVPJC-UHFFFAOYSA-N

• (S)-3-Amino-4-phenylbutyric acid hydrochloride
IUPAC Name: (3S)-3-amino-4-phenylbutanoic acid hydrochloride | CAS Registry Number: 138165-77-2
Synonyms: L-beta-Homophenylalanine, 03769_FLUKA, L-beta-Homophenylalanine hydrochloride, BL732-1, TL8006137

Molecular Formula: C10H14ClNO2Molecular Weight: 215.676660 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: MQTMGKGSJOPWJW-FVGYRXGTSA-N

• 3,4-Dimethylaniline-6-Sulfonic Acid
IUPAC Name: 2-amino-4,5-dimethylbenzenesulfonic acid | CAS Registry Number: 56375-83-8
Synonyms: 5-Amino-o-xylene-4-sulphonic acid, EINECS 260-136-3

Molecular Formula: C8H11NO3SMolecular Weight: 201.242840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XROQUIUUGKYCQN-UHFFFAOYSA-N

• 5-Chloroacetyl-6-chlorooxindole
IUPAC Name: 6-chloro-5-(2-chloroacetyl)-1,3-dihydroindol-2-one | CAS Registry Number: 118307-04-3
Synonyms: ZINC02527714, BB_SC-4651, CID3730946, TL8000502, 5-chloroacetyl-6-chloro-1,3-dihydro-1H-indole-2-one.

Molecular Formula: C10H7Cl2NO2Molecular Weight: 244.074080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LWWVMDRRHHCTMZ-UHFFFAOYSA-N

• 5'-Chloro-5'-deoxyinosine
IUPAC Name: 9-[(2R,3R,4S,5S)-5-(chloromethyl)-3,4-dihydroxyoxolan-2-yl]-3H-purin-6-one | CAS Registry Number: 21017-05-0
Synonyms: 5'-CHLORO-5'-DEOXYINOSINE, SureCN9465564, CTK4E5671, AG-E-54223, FT-0082389, FT-0638073, FT-0651245

Molecular Formula: C10H11ClN4O4Molecular Weight: 286.671740 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: YIAFNILTVCXJKT-KQYNXXCUSA-N

• 1-(2-Chlorophenyl)ethanol
IUPAC Name: 1-(2-chlorophenyl)ethanol | CAS Registry Number: 13524-04-4
Synonyms: Ambap632, 1-(2-CHLOROPHENYL)ETHANOL, 2-Chloro-alpha-methylbenzyl alcohol, EINECS 236-868-4, Benzyl alcohol, o-chloro-.alpha.-methyl-, Benzenemethanol, 2-chloro-.alpha.-methyl-, Benzenemethanol, 2-chloro-alpha-methyl-, 132437-66-2

Molecular Formula: C8H9ClOMolecular Weight: 156.609460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DDUBOVLGCYUYFX-UHFFFAOYSA-N

• 4-Amino thiobenzamide
IUPAC Name: 4-aminobenzenecarbothioamide | CAS Registry Number: 4714-67-4
Synonyms: p-Aminothiobenzamide, p-Aminobenzothiamide, 4-Aminothiobenzamide, Benzamide, p-aminothio-, 4-Aminobenzenecarbothioamide, Benzenecarbothioamide, 4-amino-, NSC 18337, AIDS009541, AIDS-009541, NSC18337, BRN 2802376, ZINC01769093, WLN: ZR DVM2N2&2 &S-O4, Benzenecarbothioamide, 4-amino- (9CI), LS-25669, TL8006919, 3-14-00-01171 (Beilstein Handbook Reference)

Molecular Formula: C7H8N2SMolecular Weight: 152.216820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: LZJVSPPXXGXGQL-UHFFFAOYSA-N

• 2,6-Difluorophenylhydrazine
IUPAC Name: (2,6-difluorophenyl)hydrazine | CAS Registry Number: 119452-66-3
Synonyms: (2,6-difluorophenyl)hydrazine, Hydrazine,(2,6-difluorophenyl)-, ZINC02243111, ACMC-1BWGV, AC1MCUD1, SureCN359674, KSC511G0R, CTK4B1308, MolPort-001-771-722, ACT00491, ANW-47502, PC1502, SBB086333, AKOS009159079, AG-D-42403, RP20906, AC-20472, AK-32964, BR-32964, KB-165996

Molecular Formula: C6H6F2N2Molecular Weight: 144.122046 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: IPCPEQXQGSGYCE-UHFFFAOYSA-N

• 1-(2-Diisopropylaminoethyl)piperazine
IUPAC Name: N-(2-piperazin-1-ylethyl)-N-propan-2-ylpropan-2-amine | CAS Registry Number: 59955-93-0
Synonyms: 1-(2-Diisopropylamino-ethyl)-piperazine

Molecular Formula: C12H27N3Molecular Weight: 213.362880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IDWCYRNCJHGJAL-UHFFFAOYSA-N

• 3-Fluoro-4-iodonitrobenzene
IUPAC Name: 2-fluoro-1-iodo-4-nitrobenzene | CAS Registry Number: 2996-30-7
Synonyms: NSC24643, CID230102

Molecular Formula: C6H3FINO2Molecular Weight: 266.996393 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QLAFWGDKYKHVKC-UHFFFAOYSA-N

• 6-Bromo-3-cyano-4-methylcoumarin
IUPAC Name: 6-bromo-4-methyl-2-oxochromene-3-carbonitrile | CAS Registry Number: 56394-22-0
Synonyms: ST50309068, 6-bromo-4-methyl-2-oxochromene-3-carbonitrile, 6-bromo-4-methyl-2-oxo-2h-chromene-3-carbonitrile, ZINC00057986, ACMC-20alzv, AC1LEN2F, 550310_ALDRICH, AC1Q26Z9, CTK5A5071, AR-1H1088, AKOS015916285, AG-F-98026, KB-199186, FT-0640379, A831031, 6-bromo-4-methyl-2-oxo-1-benzopyran-3-carbonitrile, I14-51241, 2H-1-Benzopyran-3-carbonitrile,6-bromo-4-methyl-2-oxo-, 6-bromanyl-4-methyl-2-oxidanylidene-chromene-3-carbonitrile, 3-CYANO-6-BROMO-4-METHYLCOUMARIN;6-BROMO-3-CYANO-4-METHYLCOUMARIN;6-BROMO-4-METHYL-2-OXO-2H-CHROMENE-3-CARBONITRILE

Molecular Formula: C11H6BrNO2Molecular Weight: 264.074840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NPCFOYALAZMRDI-UHFFFAOYSA-N

• 4,5-Dimethoxyisatoic anhydride
IUPAC Name: 6,7-dimethoxy-1H-3,1-benzoxazine-2,4-dione | CAS Registry Number: 20197-92-6
Synonyms: 6,7-dimethoxy-1H-benzo[d][1,3]oxazine-2,4-dione, 4,5-Dimethoxy-isatoic anhydride, 4,5-dimethoxyisatoic anhydride, 4,5-Dimethoxy-isatoicanhydride, 6,7-dimethoxy-2H-3,1-benzoxazine-2,4(1H)-dione, 6,7-dimethoxy-1H-3,1-benzoxazine-2,4-dione, ZINC02580939, PubChem18076, AC1MBY4H, AC1Q46ZR, 6,7-dimethoxyisatoic anhydride, CTK0J9628, MolPort-000-154-627, ALBB-008785, ANW-46609, SBB004426, STK505571, AKOS000321674, AC-6644, AG-C-24024

Molecular Formula: C10H9NO5Molecular Weight: 223.182160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SHWCMBUPQTWNES-UHFFFAOYSA-N

• 3,4-Difluorohydrocinnamic acid
IUPAC Name: 3-(3,4-difluorophenyl)propanoic acid | CAS Registry Number: 161712-75-0
Synonyms: 3-(3,4-difluorophenyl)propanoic Acid, 3-(3,4-Difluorophenyl)propionic acid, Benzenepropanoic acid,3,4-difluoro-, SBB068268, AG-E-11426, AC1MCUJ5, ACMC-1BX9Z, SureCN586063, 457027_ALDRICH, AC1Q758J, CTK4D0937, MolPort-000-166-268, AC1Q7584, JRD-1692, ANW-63890, AKOS000174666, AB07245, AK-63748, KB-26737, 3,4-DIFLUORO-BENZENEPROPANOIC ACID

Molecular Formula: C9H8F2O2Molecular Weight: 186.155426 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UOZIYCHJMUNLIG-UHFFFAOYSA-N

• 1-(4-Hydroxyphenyl)-2-thiourea
IUPAC Name: (4-hydroxyphenyl)thiourea | CAS Registry Number: 1520-27-0
Synonyms: p-Hydroxyphenylthiourea, (4-Hydroxyphenyl)thiourea, USAF B-75, WLN: SUYZMR DQ, Thiourea, (4-hydroxyphenyl)-, Urea, 1-(p-hydroxyphenyl)-2-thio-, NSC 43638, AIDS114907, 4-[(Aminothioxomethyl)amino]phenol, AIDS-114907, NSC43638, BRN 1102429, ZINC00156337, Thiourea, (4-hydroxyphenyl)- (9CI), LS-160344, ST5153656, 4-13-00-01132 (Beilstein Handbook Reference)

Molecular Formula: C7H8N2OSMolecular Weight: 168.216220 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 1

InChIKey: QICKOOCQSYZYQB-UHFFFAOYSA-N

• 3,3'-Dihydroxy diphenyl disulfide
IUPAC Name: 3-[(3-hydroxyphenyl)disulfanyl]phenol | CAS Registry Number: 21101-56-4
Synonyms: Bis(3-hydroxyphenyl) Disulfide, 3,3'-Dihydroxydiphenyl disulfide, 3-[(3-hydroxyphenyl)disulfanyl]phenol, 3,3'-Dithiodiphenol, ACMC-209fhl, AC1MC4YI, Phenol, 3,3'-dithiobis-, 549312_ALDRICH, Jsp004320, 3,3'-Dihydroxydiphenyldisulphide, CTK1A1383, MolPort-001-768-641, ANW-24343, OR4665, ZINC02243468, AKOS015898662, AG-E-54843, RP28906, AC-11521, L403

Molecular Formula: C12H10O2S2Molecular Weight: 250.336600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XBNOMKROXZGMFW-UHFFFAOYSA-N

• 2-Chloro-3-hydroxybenzotrifluoride
IUPAC Name: 2-chloro-3-(trifluoromethyl)phenol | CAS Registry Number: 138377-34-1
Synonyms: 433357_ALDRICH, ZINC02558676, 2-Chloro-3-(trifluoromethyl)phenol, JRD-1293, CID2736601

Molecular Formula: C7H4ClF3OMolecular Weight: 196.554270 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BGXZMBZFGAIBDH-UHFFFAOYSA-N

• 4-Acetyl-4'-propylbiphenyl
IUPAC Name: 1-[4-(4-propylphenyl)phenyl]ethanone | CAS Registry Number: 60137-92-0
Synonyms: 1-[4-(4-propylphenyl)phenyl]ethanone, 4-ACETYL-4'-PROPYLBIPHENYL, AC1MUH7R, SureCN9406602, CTK5B1031, ZINC01504584, AKOS006212721, AG-G-14992, KB-188919, FT-0640663, A832610, Ethanone,1-(4'-propyl[1,1'-biphenyl]-4-yl)-, I14-9093

Molecular Formula: C17H18OMolecular Weight: 238.324220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LMOXYMSDLCVONT-UHFFFAOYSA-N

• 3,5-Difluorobenzenesulphonamide
IUPAC Name: 3,5-difluorobenzenesulfonamide | CAS Registry Number: 140480-89-3
Synonyms: 3,5-DIFLUOROBENZENESULFONAMIDE, 559563_ALDRICH, CHEBI:42566, JRD-1790, CID446275, ZINC02576766, DB02087, ST5408478, FBU

Molecular Formula: C6H5F2NO2SMolecular Weight: 193.171206 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: MKQPOVUFDWKPNO-UHFFFAOYSA-N

• 2-(5-Mercaptotetrazole-1-yl)ethanol
IUPAC Name: 1-(2-hydroxyethyl)-2H-tetrazole-5-thione | CAS Registry Number: 56610-81-2
Synonyms: 2-(5-Mercaptotetrazole-1yl)ethanol, SBB066985, AG-F-98958, PubChem9174, SureCN1142098, CTK5A5418, CTK8A5114, MolPort-001-768-807, ACT07240, AKOS006306577, AKOS013465674, AG-C-19873, BCP9000079, KB-66898, FT-0080555, FT-0640399, 1-(2-Hydroxyethyl)-5-mercapto-1H-tetrazole, 2-(5-MERCAPTO-TETRAZOLE-1-YL)ETHANOL, |A-(5- Mercapto-1H- Tetrazole C1)-Ethanol, 2-(5-sulfanyl-1,2,3,4-tetrazol-1-yl)ethanol

Molecular Formula: C3H6N4OSMolecular Weight: 146.170940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YKYUEQRWYGVUKB-UHFFFAOYSA-N

• 2-Bromo-1-(2,6-dimethoxyphenyl)ethanone
IUPAC Name: 2-bromo-1-(2,6-dimethoxyphenyl)ethanone | CAS Registry Number: 123184-19-0
Synonyms: 2-bromo-1-(2,6-dimethoxyphenyl)ethanone, Ethanone,2-bromo-1-(2,6-dimethoxyphenyl)-, ZINC02576089, AC1MBUP4, ACMC-1C52X, CTK4B3415, SBB079731, AKOS015912069, AG-D-49964, KB-93668, 2-Bromo-1-(2,6-dimethoxyphenyl)-ethanone, 2-Bromo-1-(2,6-dimethoxyphenyl)ethanone;, KB-168646, 2-bromanyl-1-(2,6-dimethoxyphenyl)ethanone, 2-bromo-1-(2,6-dimethoxy-phenyl)-ethanone, FT-0642997, 1-(2,6-dimethoxyphenyl)-2-bromoethan-1-one, A805024, I14-36474, F2108-0334

Molecular Formula: C10H11BrO3Molecular Weight: 259.096540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NCSDTJAJQKENMG-UHFFFAOYSA-N

• 7-Fluoro-6-nitro-4-hydroxy-quinazoline
IUPAC Name: 7-fluoro-6-nitro-1H-quinazolin-4-one | CAS Registry Number: 162012-69-3
Synonyms: 7-Fluoro-6-nitro-4-hydroxyquinazoline, 7-Fluoro-6-nitroquinazolin-4(3H)-one, AG-E-11769, ZINC03888591, nchembio866-comp43, AC1OEVN8, SureCN25844, AC1Q1WZ7, SureCN1766092, SureCN7807548, KSC174G8D, CTK0H4381, CTK5I2868, VTUAEMSZEIGQRM-UHFFFAOYSA-, 7-fluoro-6-nitroquinazolin-4-ol, MolPort-002-470-853, MolPort-005-937-194, 7-Fluoro-6-nitro-quinazolin-4-ol, ANW-49804, SBB078284

Molecular Formula: C8H4FN3O3Molecular Weight: 209.134063 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VTUAEMSZEIGQRM-UHFFFAOYSA-N

• (1S)-(+)-2-Azabicyclo[2.2.1]hept-5-en-3-one
IUPAC Name: (1S,4R)-6-azabicyclo[2.2.1]hept-2-en-5-one | CAS Registry Number: 130931-83-8
Synonyms: ZINC00158452

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DDUFYKNOXPZZIW-CRCLSJGQSA-N

• 2,2'-Dinitro-4,4'-dichloro diphenyl disufide
IUPAC Name: 4-chloro-1-(4-chloro-2-nitrophenyl)disulfanyl-2-nitrobenzene | CAS Registry Number: 2050-66-0
Synonyms: NSC6334, Bis(4-chloro-2-nitrophenyl) disulfide, CID74907, NSC 6334, EINECS 218-094-9, Disulfide, bis(4-chloro-2-nitrophenyl), ZINC01693408, Bis(4-chloro-2-nitrophenyl) disulphide, AI3-08871, ST5409781, TL8006845, BIS(2-NITRO-4-CHLOROPHENYL)DISULFIDE, 4-Chloro-1-[(4-chloro-2-nitrophenyl)disulfanyl]-2-nitrobenzene

Molecular Formula: C12H6Cl2N2O4S2Molecular Weight: 377.223040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: DESADCWXGJLRSR-UHFFFAOYSA-N

• 4-(4-Bromo-2,6-dimethylphenyl)-3-thiosemicarbazide
IUPAC Name: 1-amino-3-(4-bromo-2,6-dimethylphenyl)thiourea | CAS Registry Number: 122813-72-3
Synonyms: ST51041856, 1-amino-3-(4-bromo-2,6-dimethylphenyl)thiourea, N-(4-Bromo-2,6-dimethylphenyl)hydrazinecarbothioamide, Hydrazinecarbothioamide,N-(4-bromo-2,6-dimethylphenyl)-, NSC372365, ACMC-20a3so, AC1MC3LD, CTK4B3275, MolPort-000-151-972, ANW-55846, ZINC06484478, AKOS009158992, AG-D-49440, NSC 372365, NSC-372365, AK-56173, KB-82072, FT-0642990, 3-amino-1-(4-bromo-2,6-dimethylphenyl)thiourea, A804969

Molecular Formula: C9H12BrN3SMolecular Weight: 274.180680 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: DILNFZLORSLUJR-UHFFFAOYSA-N

• (+/-)-Methadone-D3
IUPAC Name: 1,1,1-trideuterio-6-(dimethylamino)-4,4-diphenylheptan-3-one | CAS Registry Number: 60263-63-0
Synonyms: DL-Methadone-d3 solution, DL-Methadone-(heptyl-1,1,1-d3) solution, FT-0640678, DL-6-Dimethylamino-4,4-diphenyl-3-heptanone-1,1,1-d3 solution

Molecular Formula: C21H27NOMolecular Weight: 312.463665 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USSIQXCVUWKGNF-FIBGUPNXSA-N

• 2-Amino-4-fluoro-6-phenoxypyrimidine
IUPAC Name: 4-fluoro-6-phenoxypyrimidin-2-amine | CAS Registry Number: 314029-36-2
Synonyms: 4-Fluoro-6-phenoxy-pyrimidin-2-ylamine, 4-fluoro-6-phenoxypyrimidin-2-amine, 4-Fluoro-6-phenoxypyrimidin-2-ylamine, ST4053396, ZINC00194209, AC1LF7N2, Oprea1_574119, Oprea1_615400, CTK4G7064, MolPort-002-707-306, ANW-59962, STK676234, 2-Pyrimidinamine,4-fluoro-6-phenoxy-, AKOS005594284, AG-F-04631, MCULE-9342904219, RL03108, 6-fluoro-4-phenoxypyrimidine-2-ylamine, AK-29132, HC210102

Molecular Formula: C10H8FN3OMolecular Weight: 205.188423 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: VAALKUKMPRWQEX-UHFFFAOYSA-N

• 5-Amino-2-fluorobenzoic acid
IUPAC Name: 5-amino-2-fluorobenzoic acid | CAS Registry Number: 56741-33-4
Synonyms: 5-Amino-2-fluorobenzioc acid, 3-amino-6-fluorobenzoic acid, 5-Amino-2-fluorobenzoicacid, SBB028316, PubChem1325, SureCN416879, AC1MC4E1, KSC269G4F, 3-Amino-6-fluorobenzoicacid;, AC1Q51L8, RARECHEM AL BO 1979, Benzoicacid, 5-amino-2-fluoro-, CTK1G9342, BUTTPARK 19\01-52, MolPort-000-151-064, ACT11911, ANW-54076, STL353603, AKOS001419368, AC-3885

Molecular Formula: C7H6FNO2Molecular Weight: 155.126443 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WYGAIOJWQDRBRJ-UHFFFAOYSA-N

• 2-Bromo-4,6-difluoroanisole
IUPAC Name: 1-bromo-3,5-difluoro-2-methoxybenzene | CAS Registry Number: 202865-59-6
Synonyms: 579912_ALDRICH, ZINC02545227, JRD-1266, CID2736263, ST5320243

Molecular Formula: C7H5BrF2OMolecular Weight: 223.014806 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MFXWQGHKLXJIIP-UHFFFAOYSA-N

• 1H,1H,5H-Octafluoropentyl-1,1,2,2-tetrafluoroethylether
IUPAC Name: 1,1,2,2,3,3,4,4-octafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane | CAS Registry Number: 16627-71-7
Synonyms: 1,1,2,2,3,3,4,4-octafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane, AC1MD2MP, CTK4D2294, MolPort-000-157-863, ANW-73121, AKOS005762836, AG-E-15786, PC10021, AK106195, KB-216098, FT-0637386, A810711, I14-41681, 1H,1H,5H-Perfluoropentyl-1,1,2,2-tetrafluoroethylether, 1h,1h,5h-octafluoropentyl 1,1,2,2-tetrafluoroethyl ether, 1h,1h,5h-octafluoropentyl 1,12,2-tetrafluoroethyl ether, 1H,1H,5H-Octafluoropentyl-1,1,2,2-tetrafluoroethyl ether, 1h,1h,5h-perfluoropentyl-1,1,2,2-tetrafluoroethyl ether, 2,2,3,3,4,4,5,5-octafluoro-1-(1,1,2,2-tetrafluoro-ethoxy)pentane, 2,2,3,3,4,4,5,5-octafluoro-1-(1,1,2,2-tetrafluoroethoxy)pentane

Molecular Formula: C7H4F12OMolecular Weight: 332.086898 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 13

InChIKey: ZNBGTBKGFZMWKR-UHFFFAOYSA-N

• (2,6-Dimethylphenyl) methylcyanocarbonimidodithioate
IUPAC Name: [(2,6-dimethylphenyl)sulfanyl-methylsulfanylmethylidene]cyanamide | CAS Registry Number: 152382-30-4
Synonyms: ZINC04290446, AC1MC4KG, (2,6-Dimethylphenyl) methyl, (2,6-dimethylphenyl)methylcyanocarbonimidodithioate, (2,6-dimethylphenyl) methylcyanocarbonimidodithioate, (2,6-Dimethylphenyl) methyl cyanocarbonimidodithioate, [(2,6-dimethylphenyl)sulfanyl-methylsulfanylmethylidene]cyanamide

Molecular Formula: C11H12N2S2Molecular Weight: 236.356380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RHEHLHMJKOWAAM-UHFFFAOYSA-N

• 4-chloro-3-(trifluoromethyl)benzaldehyde
IUPAC Name: 4-chloro-3-(trifluoromethyl)benzaldehyde | CAS Registry Number: 34328-46-6
Synonyms: 481785_ALDRICH, ZINC04253841, 4-Chloro-3-(trifluoromethyl)benzaldehyde, JRD-0793, EINECS 251-940-5, CID118642, SBB003468

Molecular Formula: C8H4ClF3OMolecular Weight: 208.564970 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: NIHMMULLFBKTOK-UHFFFAOYSA-N

• 4'-[(2-n-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-[1,1'-biphenyl]-2-carbonitrile
IUPAC Name: 2-[4-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]phenyl]benzonitrile | CAS Registry Number: 138401-24-8
Synonyms: [1,1'-Biphenyl]-2-carbonitrile, 4'-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-, 4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]biphenyl-2-carbonitrile, [1,1'-Biphenyl]-2-carbonitrile,4'-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-, 4'-((2-butyl-4-oxo-1,3-diazaspiro(4.4)non-1-en-3-yl)methyl)biphenyl-2-carbonitrile, [1.1 inverted exclamation marka-Biphenyl]-2-carbonitrile-4-[(2-butyl-4-oxo-1.3-diazaspiro [4.4]non-1-en-3-yl)methyl], 4'-((2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl)-[1,1'-biphenyl]-2-carbonitrile, 4'-[(2-BUTYL-4-OXO-1,3-DIAZASPIRO[4.4]NON-1-EN-3-YL)METHYL]-(1,1'-BIPHENYL)-2-CARBONITRILE, 4'-[(2-Butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-[1,1'-Biphenyl]-2-carbonitrile, 4'-[(2-N-BUTYL-4-OXO-1,3-DIAZASPIRO[4.4]NON-1-EN-3-YL)METHYL]-(1,1'-BIPHENYL)-2-CARBONITRILE, 4'-[(2-n-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-[1,1'-biphenyl]-2-carbonitrile, ACMC-20mxjx, SureCN1316335, CHEMBL332051, CTK4C1245, CHEBI:286513, MolPort-003-986-399, ZINC13833593, AKOS015895294, AB25775, AG-D-77703

Molecular Formula: C25H27N3OMolecular Weight: 385.501380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KWEQEHOPDHARIA-UHFFFAOYSA-N

• 5-Carboxy-2,1,3-benzoxadiazol-1-ium-1-olate
IUPAC Name: 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylic acid | CAS Registry Number: 6086-24-4
Synonyms: ChemDiv3_001931, Benzofuroxan-5-carboxylic acid, NSC343748, 5-Benzofurazancarboxylic acid, 1-oxide, IDI1_020897, A2304/0097120

Molecular Formula: C7H4N2O4Molecular Weight: 180.117660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: AXRCJZJVVZUOHN-UHFFFAOYSA-N

• 1-(3-Acetamidophenyl)-5-mercaptotetrazole
IUPAC Name: N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]acetamide | CAS Registry Number: 14070-48-5
Synonyms: Oprea1_332745, ZINC00105347, EINECS 237-924-0, CID712430, SB 02024, SR-01000644312-1, Acetamide, N-(3-(2,5-dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl)-, N-(3-(2,5-Dihydro-5-thioxo-1H-tetrazol-1-yl)phenyl)acetamide

Molecular Formula: C9H9N5OSMolecular Weight: 235.265660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SCWKACOBHZIKDI-UHFFFAOYSA-N

• 2-Amino-4-hydroxy-6-phenylpyrimidine
IUPAC Name: 2-amino-6-phenyl-1H-pyrimidin-4-one | CAS Registry Number: 56741-94-7
Synonyms: ChemDiv2_000111, Oprea1_175017, 2-Amino-6-phenyl-pyrimidin-4-ol, NSC42141, NSC212187, ZINC00040022, ZINC04555874, 2-amino-6-phenyl-3H-pyrimidin-4-one, 2-Amino-6-phenyl-4(1H)-pyrimidinone, 2-amino-6-phenyl-4(3H)-pyrimidinone, SDCCGMLS-0065515.P001, 4(1H)-Pyrimidinone, 2-amino-6-phenyl-, TL8003666, AF-936/31346025, T0515-8624

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

InChIKey: KXYGHDWFGFZJPJ-UHFFFAOYSA-N

• (R)-(+)-3-Aminoquinuclidine dihydrochloride
IUPAC Name: (3R)-1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride | CAS Registry Number: 123536-14-1
Synonyms: (R)-3-Aminoquinuclidine dihydrochloride, (3R)-1-azabicyclo[2.2.2]octan-3-amine dihydrochloride, (3R)-Quinuclidin-3-amine dihydrochloride, (R)-(-)-3-Aminoquinuclidine dihydrochloride, (S)-(-)-3-Aminoquinuclidine dihydrochloride, PubChem9967, SureCN260467, SureCN7441414, 415715_ALDRICH, CTK3J6051, MolPort-001-769-432, ANW-44130, (R)-3-AMINOQUINUCLIDINE 2HCL, AKOS015845596, AKOS015894519, AC-4631, AC38289, AG-B-75127, PB27474, RP25674

Molecular Formula: C7H16Cl2N2Molecular Weight: 199.121340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: STZHBULOYDCZET-KLXURFKVSA-N

• 6-Bromo-4-hydroxy-2-(trifluoromethyl)quinoline
IUPAC Name: 6-bromo-2-(trifluoromethyl)-1H-quinolin-4-one | CAS Registry Number: 1701-22-0
Synonyms: 6-bromo-2-(trifluoromethyl)quinolin-4-ol, 6-Bromo-2-trifluoromethyl-quinolin-4-ol, 6-bromo-2-(trifluoromethyl)-1H-quinolin-4-one, NSC128778, PubChem5927, AC1L5OXS, Maybridge3_004065, AC1Q4IJ5, SureCN4214227, CTK4D3492, MolPort-000-152-133, HMS1442I17, ACT08279, AR-1H1039, PC1476, AKOS005203142, AKOS009159389, AC-7371, AG-C-08111, AG-E-19382

Molecular Formula: C10H5BrF3NOMolecular Weight: 292.052010 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: HIBGBUAHZUWVNW-UHFFFAOYSA-N

• 2-Cyclohexylbenzaldehyde
IUPAC Name: 2-cyclohexylbenzaldehyde | CAS Registry Number: 128323-04-6
Synonyms: cyclohexyl-benzaldehyde, Benzaldehyde, cyclohexyl-, AGN-PC-001SCN, MolPort-002-499-597, ACT00284, ANW-47011, SBB062913, ZINC12649586, AKOS006294848, AC-6638, AG-D-58467, AK-78898, KB-23456, FT-0643085, X9726, A-2049, I14-36207

Molecular Formula: C13H16OMolecular Weight: 188.265540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SFNWXOPQLKYXHN-UHFFFAOYSA-N


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