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1249944-44-2 | 1-ETHYL-3,5-DIMETHYL-1H-PYRAZOLE-4-SULFONAMIDE
CAS No: 1249944-44-2 Catalog No: AG01B2XE MDL No:MFCD14658030
Product Description
Catalog Number:
AG01B2XE
Chemical Name:
1-ETHYL-3,5-DIMETHYL-1H-PYRAZOLE-4-SULFONAMIDE
CAS Number:
1249944-44-2
Molecular Formula:
C7H13N3O2S
Molecular Weight:
203.2620
MDL Number:
MFCD14658030
IUPAC Name:
1-ethyl-3,5-dimethylpyrazole-4-sulfonamide
InChI:
InChI=1S/C7H13N3O2S/c1-4-10-6(3)7(5(2)9-10)13(8,11)12/h4H2,1-3H3,(H2,8,11,12)
InChI Key:
BWDPJUPWEIZDIZ-UHFFFAOYSA-N
SMILES:
CCn1nc(c(c1C)S(=O)(=O)N)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.073g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.26g/mol
Monoisotopic Mass:
203.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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