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89808-09-3 | 5-Pyrimidinol, 2-chloro-4,6-dimethyl-
CAS No: 89808-09-3 Catalog No: AG003Y6E MDL No:
Product Description
Catalog Number:
AG003Y6E
Chemical Name:
5-Pyrimidinol, 2-chloro-4,6-dimethyl-
CAS Number:
89808-09-3
Molecular Formula:
C6H7ClN2O
Molecular Weight:
158.5856
IUPAC Name:
2-chloro-4,6-dimethylpyrimidin-5-ol
InChI:
InChI=1S/C6H7ClN2O/c1-3-5(10)4(2)9-6(7)8-3/h10H,1-2H3
InChI Key:
ZMFHKOIHELTRSB-UHFFFAOYSA-N
SMILES:
Clc1nc(C)c(c(n1)C)O
Properties
Complexity:
110
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:
1
Isotope Atom Count:
0
Molecular Weight:
158.585g/mol
Monoisotopic Mass:
158.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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