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51045-35-3 | 1-(2-CYANOPHENYL)-N-METHYLMETHANESULFONAMIDE
CAS No: 51045-35-3 Catalog No: AG00DRFA MDL No:MFCD07847853
Product Description
Catalog Number:
AG00DRFA
Chemical Name:
1-(2-CYANOPHENYL)-N-METHYLMETHANESULFONAMIDE
CAS Number:
51045-35-3
Molecular Formula:
C9H10N2O2S
Molecular Weight:
210.2529
MDL Number:
MFCD07847853
IUPAC Name:
1-(2-cyanophenyl)-N-methylmethanesulfonamide
InChI:
InChI=1S/C9H10N2O2S/c1-11-14(12,13)7-9-5-3-2-4-8(9)6-10/h2-5,11H,7H2,1H3
InChI Key:
WNDNPRAXAXKVGM-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1CS(=O)(=O)NC
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.251g/mol
Monoisotopic Mass:
210.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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