CSCCC(=O)Cl
CAS: 7031-23-4
Name: 3-methylsulfanylpropanoyl chloride
SMILES: CSCCC(=O)Cl

Molecular Processing

Molecular formula
C4H7ClOS
Molecular weight
138.62
Exact mass
137.9906
XLogP
1.5
TPSA
17.07
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
33.86

Supplementary Information

InChIKey: NRHMXMBVLXSSAX-UHFFFAOYSA-N
Synonyme
3-(Methylthio)propionyl ChlorideRefChem:495604678-606-57031-23-43-(methylsulfanyl)propanoyl chloride3-methylsulfanylpropanoyl chloridePropanoyl chloride, 3-(methylthio)-MFCD00059482SCHEMBL289643CHEMBL326737methylsulfanyl-propionyl chloride3-(methylthio)propanoyl chloride3-methylmercaptopropionyl chlorideDTXSID405130283-Methylsulfanyl-propionyl chlorideSTR051443-(Methylmercapto)propionyl Chloride3-(methylsulphenyl)propanoyl chlorideAKOS008901444M0806D913873-(Methylsulfanyl)propanoyl chloride, AldrichCPREN300-7190144F477805
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