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2-Methyl-2-propanyl (5R)-5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxylate | CAS No. 872624-60-7

2-Methyl-2-propanyl (5R)-5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxylate

Basic Information

Chemical_Structure_Of

CAS Number

872624-60-7

Molecular Formula

C17H22F3NO3

Molecular Weight

345.36 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

CC1=CC2=C(C=C1C(F)(F)F)N(CCCC2O)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H22F3NO3/c1-10-8-11-13(9-12(10)17(18,19)20)21(7-5-6-14(11)22)15(23)24-16(2,3)4/h8-9,14,22H,5-7H2,1-4H3/t14-/m1/s1

InChIKey

PCWLNIVCVKFQRY-CQSZACIVSA-N

LogP

4.582520000000004

Topological Polar Surface Area

49.77000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

461

Synonyms & References

English

tert-butyl (r)-5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1h-benzo[b]azepine-1-carboxylate
(R)-tert-Butyl 5-hydroxy-7-methyl-8-trifluoromethyl-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylate
(R)-tert-Butyl5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carboxylate
(R)-tert-Butyl 5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carboxylate
DTXSID70732008
tert-Butyl (5R)-5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxylate
872624-60-7
SCHEMBL2479682
1H-1-Benzazepine-1-carboxylic acid, 2,3,4,5-tetrahydro-5-hydroxy-7-Methyl-8-(trifluoroMethyl)-, 1,1-diMethylethyl ester, (5R)
1H-1-Benzazepine-1-carboxylic acid, 2,3,4,5-tetrahydro-5-hydroxy-7-Methyl-8-(trifluoroMethyl)-, 1,1-diMethylethyl ester, (5R)-
1H-1-Benzazepine-1-carboxylic acid, 2,3,4,5-tetrahydro-5-hydroxy-7-methyl-8-(trifluoromethyl)-...
tert-butyl (5R)-5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate

MDL Number

MFCD12964222

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

1,3-Dibromo-2,4-dichloro-5-fluorobenzene

CAS Number: 1000573-45-4

Molecular Formula: C6HFCl2Br2

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine

CAS Number: 103687-96-3

Molecular Formula: C17H19NO5S

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine

CAS Number: 112897-99-1

Molecular Formula: C30H31N3O7

Darunavir-d9 structure

Darunavir-d9

CAS Number: 1133378-37-6

Molecular Formula: C27H28D9N3O7S

2-Bromo-3-isopropoxypyridine structure

2-Bromo-3-isopropoxypyridine

CAS Number: 113503-65-4

Molecular Formula: C8H10BrNO

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate structure

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate

CAS Number: 116543-91-0

Molecular Formula: C11H7FO4

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile

CAS Number: 121055-10-5

Molecular Formula: C17H17NO4

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number: 1263059-26-2

Molecular Formula: C8H6ClN3O2

8-Bromoisoquinolin-1-amine structure

8-Bromoisoquinolin-1-amine

CAS Number: 1337879-85-2

Molecular Formula: C9H7BrN2

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Supplier Information

Shanghai Xuren Chemical Technology Co., Ltd.

CAS Number: 872624-60-7

Shanghai Yuyeh Biotechnology Co., Ltd.

CAS Number: 872624-60-7

ShenZhenAiTaHuaXue Co Ltd

CAS Number: 872624-60-7

JiangSuAiKangShengWuYiYaoYanFa Co Ltd

CAS Number: 872624-60-7