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1240390-28-6 | 5-Pyrimidinecarboxamide, 2,4-dichloro-
CAS No: 1240390-28-6 Catalog No: AG000LFR MDL No:MFCD16658133
Product Description
Catalog Number:
AG000LFR
Chemical Name:
5-Pyrimidinecarboxamide, 2,4-dichloro-
CAS Number:
1240390-28-6
Molecular Formula:
C5H3Cl2N3O
Molecular Weight:
192.0028
MDL Number:
MFCD16658133
IUPAC Name:
2,4-dichloropyrimidine-5-carboxamide
InChI:
InChI=1S/C5H3Cl2N3O/c6-3-2(4(8)11)1-9-5(7)10-3/h1H,(H2,8,11)
InChI Key:
OACCNUGECQQVLB-UHFFFAOYSA-N
SMILES:
Clc1ncc(c(n1)Cl)C(=O)N
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.965g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.999g/mol
Monoisotopic Mass:
190.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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