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1240595-42-9 | Pyrimidine, 4-chloro-5-fluoro-2-(2-pyridinyl)-
CAS No: 1240595-42-9 Catalog No: AG000LH8 MDL No:MFCD16987875
Product Description
Catalog Number:
AG000LH8
Chemical Name:
Pyrimidine, 4-chloro-5-fluoro-2-(2-pyridinyl)-
CAS Number:
1240595-42-9
Molecular Formula:
C9H5ClFN3
Molecular Weight:
209.6075
MDL Number:
MFCD16987875
IUPAC Name:
4-chloro-5-fluoro-2-pyridin-2-ylpyrimidine
InChI:
InChI=1S/C9H5ClFN3/c10-8-6(11)5-13-9(14-8)7-3-1-2-4-12-7/h1-5H
InChI Key:
XTWUJSDSBJYPKV-UHFFFAOYSA-N
SMILES:
Fc1cnc(nc1Cl)c1ccccn1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.016g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.608g/mol
Monoisotopic Mass:
209.016g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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