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1261268-83-0 | Methanesulfonamide, N-[4-(2H-tetrazol-5-yl)phenyl]-
CAS No: 1261268-83-0 Catalog No: AG000RP8 MDL No:MFCD18375289
Product Description
Catalog Number:
AG000RP8
Chemical Name:
Methanesulfonamide, N-[4-(2H-tetrazol-5-yl)phenyl]-
CAS Number:
1261268-83-0
Molecular Formula:
C8H9N5O2S
Molecular Weight:
239.2544
MDL Number:
MFCD18375289
IUPAC Name:
N-[4-(2H-tetrazol-5-yl)phenyl]methanesulfonamide
InChI:
InChI=1S/C8H9N5O2S/c1-16(14,15)11-7-4-2-6(3-5-7)8-9-12-13-10-8/h2-5,11H,1H3,(H,9,10,12,13)
InChI Key:
XRVKANXVOQNJPL-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Nc1ccc(cc1)c1nn[nH]n1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.048g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.253g/mol
Monoisotopic Mass:
239.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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