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1245506-61-9 | Pyrimidine, 2-chloro-5-methoxy-4-methyl-
CAS No: 1245506-61-9 Catalog No: AG000M6X MDL No:MFCD22394135
Product Description
Catalog Number:
AG000M6X
Chemical Name:
Pyrimidine, 2-chloro-5-methoxy-4-methyl-
CAS Number:
1245506-61-9
Molecular Formula:
C6H7ClN2O
Molecular Weight:
158.5856
MDL Number:
MFCD22394135
IUPAC Name:
2-chloro-5-methoxy-4-methylpyrimidine
InChI:
InChI=1S/C6H7ClN2O/c1-4-5(10-2)3-8-6(7)9-4/h3H,1-2H3
InChI Key:
GBQFWSOESDYTPU-UHFFFAOYSA-N
SMILES:
COc1cnc(nc1C)Cl
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.585g/mol
Monoisotopic Mass:
158.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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