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133171-80-9 | N-Isobutylmethanesulfonamide
CAS No: 133171-80-9 Catalog No: AG009Z6B MDL No:MFCD01212950
Product Description
Catalog Number:
AG009Z6B
Chemical Name:
N-Isobutylmethanesulfonamide
CAS Number:
133171-80-9
Molecular Formula:
C5H13NO2S
Molecular Weight:
151.2272
MDL Number:
MFCD01212950
IUPAC Name:
N-(2-methylpropyl)methanesulfonamide
InChI:
InChI=1S/C5H13NO2S/c1-5(2)4-6-9(3,7)8/h5-6H,4H2,1-3H3
InChI Key:
XBGDRQUFMJRVAL-UHFFFAOYSA-N
SMILES:
CC(CNS(=O)(=O)C)C
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.067g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.224g/mol
Monoisotopic Mass:
151.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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