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61515-41-1 | 3-(2-chloroethanesulfonyl)propanoyl chloride
CAS No: 61515-41-1 Catalog No: AG01FHLX MDL No:
Product Description
Catalog Number:
AG01FHLX
Chemical Name:
3-(2-chloroethanesulfonyl)propanoyl chloride
CAS Number:
61515-41-1
Molecular Formula:
C5H8Cl2O3S
Molecular Weight:
219.0862
IUPAC Name:
3-(2-chloroethylsulfonyl)propanoyl chloride
InChI:
InChI=1S/C5H8Cl2O3S/c6-2-4-11(9,10)3-1-5(7)8/h1-4H2
InChI Key:
KAKDHLJJBBJUHT-UHFFFAOYSA-N
SMILES:
ClCCS(=O)(=O)CCC(=O)Cl
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.957g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.076g/mol
Monoisotopic Mass:
217.957g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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