3-(Benzylthio)propionic acid

Catalog Number

ACM2899663

Product Name

3-(Benzylthio)propionic acid

Structure

CAS

2899-66-3

Category

Heterocyclic Organic Compound

Synonyms

NSC5996, NCIStruc1_000201, NCIStruc2_000051, 3-(benzylthio)propanoic acid, 3-(Benzylthio)propionic acid, NCI5996, NSC8528, Propionic acid, 3-(benzylthio)-, .beta.-(Benzylthio)propionic acid, NSC-5996, NCGC00013065, S-Benzyl-.beta.-mercaptopropionic acid, NCGC00096189-01, NCI60_004460, Propanoic acid, 3-[(phenylmethyl)thio]-, ST5444558, 2899-66-3

IUPAC Name

3-(phenylmethylsulfanyl)propanoic acid

Molecular Weight

196.27

Molecular Formula

C₁₀H₁₂O₂S

Canonical SMILES

C1=CC=C(C=C1)CSCCC(=O)O

InChI Key

NDBNSZKHDMXOJE-UHFFFAOYSA-N

Boiling Point

351.6ºC at 760mmHg

Flash Point

166.4ºC

Density

1.197g/cm³

EC Number

608-304-0

Exact Mass

196.05600

Hazard Statements

Xn

H-Bond Acceptor

2

H-Bond Donor

1

Safety Description

26-36

MSDS

COA

Spec Sheet