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182244-13-9 | 2-Pyrazinecarboxamide, 6-chloro-5-propyl-
CAS No: 182244-13-9 Catalog No: AG0023IN MDL No:
Product Description
Catalog Number:
AG0023IN
Chemical Name:
2-Pyrazinecarboxamide, 6-chloro-5-propyl-
CAS Number:
182244-13-9
Molecular Formula:
C8H10ClN3O
Molecular Weight:
199.6375
IUPAC Name:
6-chloro-5-propylpyrazine-2-carboxamide
InChI:
InChI=1S/C8H10ClN3O/c1-2-3-5-7(9)12-6(4-11-5)8(10)13/h4H,2-3H2,1H3,(H2,10,13)
InChI Key:
IEIAGXSRXRZDPO-UHFFFAOYSA-N
SMILES:
CCCc1ncc(nc1Cl)C(=O)N
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.638g/mol
Monoisotopic Mass:
199.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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