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1148027-05-7 | N-(1-cyanocyclohexyl)-4-methylbenzene-1-sulfonamide
CAS No: 1148027-05-7 Catalog No: AG00JWCS MDL No:MFCD11226419
Product Description
Catalog Number:
AG00JWCS
Chemical Name:
N-(1-cyanocyclohexyl)-4-methylbenzene-1-sulfonamide
CAS Number:
1148027-05-7
Molecular Formula:
C14H18N2O2S
Molecular Weight:
278.3699
MDL Number:
MFCD11226419
IUPAC Name:
N-(1-cyanocyclohexyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C14H18N2O2S/c1-12-5-7-13(8-6-12)19(17,18)16-14(11-15)9-3-2-4-10-14/h5-8,16H,2-4,9-10H2,1H3
InChI Key:
PFKWBUMANLCJPF-UHFFFAOYSA-N
SMILES:
N#CC1(CCCCC1)NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.109g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.37g/mol
Monoisotopic Mass:
278.109g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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