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52206-52-7 | 2-methyl-1,3-benzoxazole-6-sulfonamide
CAS No: 52206-52-7 Catalog No: AG01AJ0E MDL No:MFCD19381992
Product Description
Catalog Number:
AG01AJ0E
Chemical Name:
2-methyl-1,3-benzoxazole-6-sulfonamide
CAS Number:
52206-52-7
Molecular Formula:
C8H8N2O3S
Molecular Weight:
212.2257
MDL Number:
MFCD19381992
IUPAC Name:
2-methyl-1,3-benzoxazole-6-sulfonamide
InChI:
InChI=1S/C8H8N2O3S/c1-5-10-7-3-2-6(14(9,11)12)4-8(7)13-5/h2-4H,1H3,(H2,9,11,12)
InChI Key:
ZOMKPSOYHIRCOT-UHFFFAOYSA-N
SMILES:
Cc1nc2c(o1)cc(cc2)S(=O)(=O)N
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.026g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.223g/mol
Monoisotopic Mass:
212.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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