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260046-12-6 | 4-Pyrimidinamine, 2-chloro-N-(4-fluorophenyl)-
CAS No: 260046-12-6 Catalog No: AG002RD3 MDL No:MFCD09756922
Product Description
Catalog Number:
AG002RD3
Chemical Name:
4-Pyrimidinamine, 2-chloro-N-(4-fluorophenyl)-
CAS Number:
260046-12-6
Molecular Formula:
C10H7ClFN3
Molecular Weight:
223.6341
MDL Number:
MFCD09756922
IUPAC Name:
2-chloro-N-(4-fluorophenyl)pyrimidin-4-amine
InChI:
InChI=1S/C10H7ClFN3/c11-10-13-6-5-9(15-10)14-8-3-1-7(12)2-4-8/h1-6H,(H,13,14,15)
InChI Key:
JAMUOHUGUQBGQA-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)Nc1ccnc(n1)Cl
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.031g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.635g/mol
Monoisotopic Mass:
223.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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