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1801-06-5 | Pyrimidine, 4-chloro-5-fluoro-2-methoxy-
CAS No: 1801-06-5 Catalog No: AG0021PK MDL No:MFCD09834963
Product Description
Catalog Number:
AG0021PK
Chemical Name:
Pyrimidine, 4-chloro-5-fluoro-2-methoxy-
CAS Number:
1801-06-5
Molecular Formula:
C5H4ClFN2O
Molecular Weight:
162.5495
MDL Number:
MFCD09834963
IUPAC Name:
4-chloro-5-fluoro-2-methoxypyrimidine
InChI:
InChI=1S/C5H4ClFN2O/c1-10-5-8-2-3(7)4(6)9-5/h2H,1H3
InChI Key:
SGXQCZHNMNMMEG-UHFFFAOYSA-N
SMILES:
COc1ncc(c(n1)Cl)F
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.548g/mol
Monoisotopic Mass:
162g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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