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1214382-49-6 | Pyrimidine, 2,4-dichloro-5-(4-pyridinyl)-
CAS No: 1214382-49-6 Catalog No: AG0014YW MDL No:MFCD15475338
Product Description
Catalog Number:
AG0014YW
Chemical Name:
Pyrimidine, 2,4-dichloro-5-(4-pyridinyl)-
CAS Number:
1214382-49-6
Molecular Formula:
C9H5Cl2N3
Molecular Weight:
226.0621
MDL Number:
MFCD15475338
IUPAC Name:
2,4-dichloro-5-pyridin-4-ylpyrimidine
InChI:
InChI=1S/C9H5Cl2N3/c10-8-7(5-13-9(11)14-8)6-1-3-12-4-2-6/h1-5H
InChI Key:
DQUFMFXHPNTTFC-UHFFFAOYSA-N
SMILES:
Clc1ncc(c(n1)Cl)c1ccncc1
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.986g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.06g/mol
Monoisotopic Mass:
224.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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