CC(=O)SCCC(=O)Cl
CAS: 41345-72-6
Nombre: S-(3-chloro-3-oxopropyl) ethanethioate
SMILES: CC(=O)SCCC(=O)Cl

Molecular Processing

Molecular formula
C5H7ClO2S
Molecular weight
166.63
Exact mass
165.9855
XLogP
1.42
TPSA
34.14
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
38.62

Supplementary Information

InChIKey: XEYWOETXQNDSED-UHFFFAOYSA-N
Sinónimos
3-(acetylsulfanyl)propanoyl chlorideRefChem:493980896-480-141345-72-6S-(3-Chloro-3-oxopropyl) ethanethioateC5H7ClO2S3-acetylthiopropanoyl chlorideSCHEMBL45897213-(Acetylthio)propanoyl chloride3-(acetylthio)propionyl chloride3-acetylmercaptopropionyl chlorideDTXSID00513549XEYWOETXQNDSED-UHFFFAOYSA-N3-(acetylsulfanyl)propanoylchlorideRBA34572MFCD28397428S-acetyl-3-mercaptopropanoyl chloride3-acetylsulfanyl-propanoic acid chlorideS-(3-chloro-3-oxo-propyl) ethanethioateEN300-206928G53357
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