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736948-74-6 | 4-acetyl-N-(furan-2-ylmethyl)benzenesulfonamide
CAS No: 736948-74-6 Catalog No: AG00ICFC MDL No:MFCD04638742
Product Description
Catalog Number:
AG00ICFC
Chemical Name:
4-acetyl-N-(furan-2-ylmethyl)benzenesulfonamide
CAS Number:
736948-74-6
Molecular Formula:
C13H13NO4S
Molecular Weight:
279.3116
MDL Number:
MFCD04638742
IUPAC Name:
4-acetyl-N-(furan-2-ylmethyl)benzenesulfonamide
InChI:
InChI=1S/C13H13NO4S/c1-10(15)11-4-6-13(7-5-11)19(16,17)14-9-12-3-2-8-18-12/h2-8,14H,9H2,1H3
InChI Key:
IXVMRHFCCUTRAI-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)S(=O)(=O)NCc1ccco1
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.057g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.31g/mol
Monoisotopic Mass:
279.057g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
84.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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