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632298-87-4 | 4-tert-butyl-N-(3-formylphenyl)benzenesulfonamide
CAS No: 632298-87-4 Catalog No: AG00JHBG MDL No:MFCD03765440
Product Description
Catalog Number:
AG00JHBG
Chemical Name:
4-tert-butyl-N-(3-formylphenyl)benzenesulfonamide
CAS Number:
632298-87-4
Molecular Formula:
C17H19NO3S
Molecular Weight:
317.4027
MDL Number:
MFCD03765440
IUPAC Name:
4-tert-butyl-N-(3-formylphenyl)benzenesulfonamide
InChI:
InChI=1S/C17H19NO3S/c1-17(2,3)14-7-9-16(10-8-14)22(20,21)18-15-6-4-5-13(11-15)12-19/h4-12,18H,1-3H3
InChI Key:
UBZNHVGVFJYNSN-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)NS(=O)(=O)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.109g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.403g/mol
Monoisotopic Mass:
317.109g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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