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1340518-40-2 | 3,5-dimethylcyclohexane-1-sulfonamide, Mixture of diastereomers
CAS No: 1340518-40-2 Catalog No: AG01B35A MDL No:MFCD20404525
Product Description
Catalog Number:
AG01B35A
Chemical Name:
3,5-dimethylcyclohexane-1-sulfonamide, Mixture of diastereomers
CAS Number:
1340518-40-2
Molecular Formula:
C8H17NO2S
Molecular Weight:
191.2911
MDL Number:
MFCD20404525
IUPAC Name:
3,5-dimethylcyclohexane-1-sulfonamide
InChI:
InChI=1S/C8H17NO2S/c1-6-3-7(2)5-8(4-6)12(9,10)11/h6-8H,3-5H2,1-2H3,(H2,9,10,11)
InChI Key:
YDNNYKRBWNVIII-UHFFFAOYSA-N
SMILES:
CC1CC(CC(C1)C)S(=O)(=O)N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.098g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.289g/mol
Monoisotopic Mass:
191.098g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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