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1196157-90-0 | SulfaMethoxazole-13C6
CAS No: 1196157-90-0 Catalog No: AG0094TS MDL No:
Product Description
Catalog Number:
AG0094TS
Chemical Name:
SulfaMethoxazole-13C6
CAS Number:
1196157-90-0
IUPAC Name:
4-amino-N-(5-methyl-1,2-oxazol-3-yl)(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-sulfonamide
InChI:
InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)/i2+1,3+1,4+1,5+1,8+1,9+1
InChI Key:
JLKIGFTWXXRPMT-AHBHZWPESA-N
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
6
Molecular Weight:
259.23g/mol
Monoisotopic Mass:
259.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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