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2927-71-1 | Pyrimidine, 2,4-dichloro-5-fluoro-
CAS No: 2927-71-1 Catalog No: AG002XX6 MDL No:MFCD00233551
Product Description
Catalog Number:
AG002XX6
Chemical Name:
Pyrimidine, 2,4-dichloro-5-fluoro-
CAS Number:
2927-71-1
Molecular Formula:
C4HCl2FN2
Molecular Weight:
166.9685
MDL Number:
MFCD00233551
IUPAC Name:
2,4-dichloro-5-fluoropyrimidine
InChI:
InChI=1S/C4HCl2FN2/c5-3-2(7)1-8-4(6)9-3/h1H
InChI Key:
WHPFEQUEHBULBW-UHFFFAOYSA-N
SMILES:
Clc1ncc(c(n1)Cl)F
EC Number:
625-810-7
NSC Number:
70442
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.95g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.964g/mol
Monoisotopic Mass:
165.95g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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