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1178430-81-3 | N-methyl-1H-pyrazole-4-sulfonamide
CAS No: 1178430-81-3 Catalog No: AG01AK5D MDL No:MFCD12784013
Product Description
Catalog Number:
AG01AK5D
Chemical Name:
N-methyl-1H-pyrazole-4-sulfonamide
CAS Number:
1178430-81-3
Molecular Formula:
C4H7N3O2S
Molecular Weight:
161.1823
MDL Number:
MFCD12784013
IUPAC Name:
N-methyl-1H-pyrazole-4-sulfonamide
InChI:
InChI=1S/C4H7N3O2S/c1-5-10(8,9)4-2-6-7-3-4/h2-3,5H,1H3,(H,6,7)
InChI Key:
JVWBPNRQROCNMH-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)c1c[nH]nc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.026g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.179g/mol
Monoisotopic Mass:
161.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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