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CAS Number: 872624-60-7
(R)-tert-butyl 5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carboxylate

Structure

 (R)-tert-butyl 5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carboxylate
Name: (R)-tert-butyl 5-hydroxy-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carboxylate
Synonyms:
General Information
Product Number: 872624607

CAS Registry Number 872624-60-7
Name:
1H-?1-?Benzazepine-?1-?carboxylic acid, 2,?3,?4,?5-?tetrahydro-?5-?hydroxy-?7-?methyl-?8-?(trifluoromethyl)?-?, 1,?1-?dimethylethyl ester, (5R)?-
(R)-tert-Butyl 5-hydroxy-7-methyl-8-trifluoromethyl-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylate

 

Chemical Formula: C17H22F3NO3
Exact Mass: 345.16
Molecular Weight: 345.36
m/z: 345.16 (100.0%), 346.16 (18.8%), 347.16 (2.3%)

 

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

InChI Key:PCWLNIVCVKFQRY-CQSZACIVSA-N

Canonical SMILES:CC1=C(C=C2C(=C1)C(CCCN2C(=O)OC(C)(C)C)O)C(F)(F)F

Specification

98%
References

PCT Int. Appl. (2006), WO 2006002342 A1 20060105.                                  
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