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139047-73-7 | 1,2,4,5-Tetrazin-3-amine, 6-(3,5-dimethyl-1H-pyrazol-1-yl)-
CAS No: 139047-73-7 Catalog No: AG001A2V MDL No:MFCD01926285
Product Description
Catalog Number:
AG001A2V
Chemical Name:
1,2,4,5-Tetrazin-3-amine, 6-(3,5-dimethyl-1H-pyrazol-1-yl)-
CAS Number:
139047-73-7
Molecular Formula:
C7H9N7
Molecular Weight:
191.1933
MDL Number:
MFCD01926285
IUPAC Name:
6-(3,5-dimethylpyrazol-1-yl)-1,2,4,5-tetrazin-3-amine
InChI:
InChI=1S/C7H9N7/c1-4-3-5(2)14(13-4)7-11-9-6(8)10-12-7/h3H,1-2H3,(H2,8,9,10)
InChI Key:
JXJYVOAONGQISS-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C)c1nnc(nn1)N
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.198g/mol
Monoisotopic Mass:
191.092g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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