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603999-00-4 | 4-cyano-N-(furan-2-ylmethyl)benzene-1-sulfonamide
CAS No: 603999-00-4 Catalog No: AG019UHS MDL No:MFCD08866960
Product Description
Catalog Number:
AG019UHS
Chemical Name:
4-cyano-N-(furan-2-ylmethyl)benzene-1-sulfonamide
CAS Number:
603999-00-4
Molecular Formula:
C12H10N2O3S
Molecular Weight:
262.2844
MDL Number:
MFCD08866960
IUPAC Name:
4-cyano-N-(furan-2-ylmethyl)benzenesulfonamide
InChI:
InChI=1S/C12H10N2O3S/c13-8-10-3-5-12(6-4-10)18(15,16)14-9-11-2-1-7-17-11/h1-7,14H,9H2
InChI Key:
XNDCZCNCAKWYHH-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)S(=O)(=O)NCc1ccco1
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.041g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.283g/mol
Monoisotopic Mass:
262.041g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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