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Home > Sulfanilamide > 951399-50-1
951399-50-1 | 1-cyano-N-[(3,4-dimethoxyphenyl)methyl]methanesulfonamide
CAS No: 951399-50-1 Catalog No: AG01AGIU MDL No:MFCD16523343
Product Description
Catalog Number:
AG01AGIU
Chemical Name:
1-cyano-N-[(3,4-dimethoxyphenyl)methyl]methanesulfonamide
CAS Number:
951399-50-1
Molecular Formula:
C11H14N2O4S
Molecular Weight:
270.3049
MDL Number:
MFCD16523343
IUPAC Name:
1-cyano-N-[(3,4-dimethoxyphenyl)methyl]methanesulfonamide
InChI:
InChI=1S/C11H14N2O4S/c1-16-10-4-3-9(7-11(10)17-2)8-13-18(14,15)6-5-12/h3-4,7,13H,6,8H2,1-2H3
InChI Key:
IZXQTMJHDPXALF-UHFFFAOYSA-N
SMILES:
N#CCS(=O)(=O)NCc1ccc(c(c1)OC)OC
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.067g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.303g/mol
Monoisotopic Mass:
270.067g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
96.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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