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1046495-78-6 | N-(TERT-BUTYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-SULFONAMIDE HYDROCHLORIDE
CAS No: 1046495-78-6 Catalog No: AG019ORG MDL No:MFCD07355834
Product Description
Catalog Number:
AG019ORG
Chemical Name:
N-(TERT-BUTYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-SULFONAMIDE HYDROCHLORIDE
CAS Number:
1046495-78-6
Molecular Formula:
C9H18ClN3O2S
Molecular Weight:
267.7761
MDL Number:
MFCD07355834
IUPAC Name:
N-tert-butyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride
InChI:
InChI=1S/C9H17N3O2S.ClH/c1-6-8(7(2)11-10-6)15(13,14)12-9(3,4)5;/h12H,1-5H3,(H,10,11);1H
InChI Key:
CGJMYWVMOOJLIE-UHFFFAOYSA-N
SMILES:
Cc1[nH]nc(c1S(=O)(=O)NC(C)(C)C)C.Cl
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.081g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
267.772g/mol
Monoisotopic Mass:
267.081g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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