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1254058-25-7 | 2-Pyrazinecarboxamide, 3,5-dichloro-6-(1-methylethyl)-
CAS No: 1254058-25-7 Catalog No: AG000NNS MDL No:MFCD22493462
Product Description
Catalog Number:
AG000NNS
Chemical Name:
2-Pyrazinecarboxamide, 3,5-dichloro-6-(1-methylethyl)-
CAS Number:
1254058-25-7
Molecular Formula:
C8H9Cl2N3O
Molecular Weight:
234.0826
MDL Number:
MFCD22493462
IUPAC Name:
3,5-dichloro-6-propan-2-ylpyrazine-2-carboxamide
InChI:
InChI=1S/C8H9Cl2N3O/c1-3(2)4-6(9)13-7(10)5(12-4)8(11)14/h3H,1-2H3,(H2,11,14)
InChI Key:
UPSCOTILBRDYLU-UHFFFAOYSA-N
SMILES:
CC(c1nc(C(=O)N)c(nc1Cl)Cl)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.012g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.08g/mol
Monoisotopic Mass:
233.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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