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914638-45-2 | 7-Benzoxazolesulfonamide, 2-(1,1-dimethylethyl)-N,N,6-trimethyl-
CAS No: 914638-45-2 Catalog No: AG006AA5 MDL No:
Product Description
Catalog Number:
AG006AA5
Chemical Name:
7-Benzoxazolesulfonamide, 2-(1,1-dimethylethyl)-N,N,6-trimethyl-
CAS Number:
914638-45-2
Molecular Formula:
C14H20N2O3S
Molecular Weight:
296.3852
IUPAC Name:
2-tert-butyl-N,N,6-trimethyl-1,3-benzoxazole-7-sulfonamide
InChI:
InChI=1S/C14H20N2O3S/c1-9-7-8-10-11(12(9)20(17,18)16(5)6)19-13(15-10)14(2,3)4/h7-8H,1-6H3
InChI Key:
JMFMSVGINJBPTB-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1S(=O)(=O)N(C)C)oc(n2)C(C)(C)C
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.119g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.385g/mol
Monoisotopic Mass:
296.119g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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