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57603-96-0 | 1-HEPTANESULFONAMIDE
CAS No: 57603-96-0 Catalog No: AG00EWRP MDL No:MFCD09955617
Product Description
Catalog Number:
AG00EWRP
Chemical Name:
1-HEPTANESULFONAMIDE
CAS Number:
57603-96-0
Molecular Formula:
C7H17NO2S
Molecular Weight:
179.2804
MDL Number:
MFCD09955617
IUPAC Name:
heptane-1-sulfonamide
InChI:
InChI=1S/C7H17NO2S/c1-2-3-4-5-6-7-11(8,9)10/h2-7H2,1H3,(H2,8,9,10)
InChI Key:
XXRLNWSPPBSGMY-UHFFFAOYSA-N
SMILES:
CCCCCCCS(=O)(=O)N
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.098g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.278g/mol
Monoisotopic Mass:
179.098g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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