CAS
28996-07-8 Purity
96%
28996-07-8 Purity
96%
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3-(Benzylthio)propionic acid
CAS
2899-66-3
Catalog Number
ACM2899663
Category
Other Products
Molecular Weight
196.27
Molecular Formula
C10H12O2S
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Specification
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
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
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