Hexahydro-1-(phenylthio)-2H-azepin-2-one

CAS

36452-23-0

Catalog Number

ACM36452230

Category

Other Products

Molecular Weight

221.3186

Molecular Formula

C₁₂H₁₅NOS

MSDS COA Spec Sheet

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Specification

Synonyms

N-(Phenylthio)caprolactam, 1-Phenylsulfanyl-azepan-2-one, MLS000071653, MolPort-001-832-558, HMS1677H16, N-(Phenylthio)-epsilon-caprolactam, N-Phenylthio-.epsilon.-caprolactam, EINECS 253-045-5, CID118982, ZINC00256136, BAS 00531433, SMR000009094, 2H-Azepin-2-one, hexahydro-1-(phenylthio)-, Hexahydro-1-(phenylthio)-2H-azepin-2-one, 36452-23-0, InChI=1/C12H15NOS/c14-12-9-5-2-6-10-13(12)15-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H

IUPAC Name

1-phenylsulfanylazepan-2-one

Canonical SMILES

C1CCC(=O)N(CC1)SC2=CC=CC=C2

InChI Key

HVIHQLGJOGGHSI-UHFFFAOYSA-N

EC Number

253-045-5

Exact Mass

221.08700

H-Bond Acceptor

H-Bond Donor