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1220695-06-6 | Cyclobutanemethanesulfonyl chloride
CAS No: 1220695-06-6 Catalog No: AG0016PR MDL No:MFCD16036603
Product Description
Catalog Number:
AG0016PR
Chemical Name:
Cyclobutanemethanesulfonyl chloride
CAS Number:
1220695-06-6
Molecular Formula:
C5H9ClO2S
Molecular Weight:
168.6418
MDL Number:
MFCD16036603
IUPAC Name:
cyclobutylmethanesulfonyl chloride
InChI:
InChI=1S/C5H9ClO2S/c6-9(7,8)4-5-2-1-3-5/h5H,1-4H2
InChI Key:
PWKSOBWFPCITKW-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)CC1CCC1
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.001g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.635g/mol
Monoisotopic Mass:
168.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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