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1260862-85-8 | 5-Pyrimidinemethanol, 4,6-dichloro-
CAS No: 1260862-85-8 Catalog No: AG000RHX MDL No:MFCD12756685
Product Description
Catalog Number:
AG000RHX
Chemical Name:
5-Pyrimidinemethanol, 4,6-dichloro-
CAS Number:
1260862-85-8
Molecular Formula:
C5H4Cl2N2O
Molecular Weight:
179.0041
MDL Number:
MFCD12756685
IUPAC Name:
(4,6-dichloropyrimidin-5-yl)methanol
InChI:
InChI=1S/C5H4Cl2N2O/c6-4-3(1-10)5(7)9-2-8-4/h2,10H,1H2
InChI Key:
OXXRISGDUFMBMW-UHFFFAOYSA-N
SMILES:
OCc1c(Cl)ncnc1Cl
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.97g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179g/mol
Monoisotopic Mass:
177.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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