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1279822-48-8 | 5-Pyrimidinemethanol, 2-chloro-α-methyl-
CAS No: 1279822-48-8 Catalog No: AG000XNC MDL No:
Product Description
Catalog Number:
AG000XNC
Chemical Name:
5-Pyrimidinemethanol, 2-chloro-α-methyl-
CAS Number:
1279822-48-8
Molecular Formula:
C6H7ClN2O
Molecular Weight:
158.5856
IUPAC Name:
1-(2-chloropyrimidin-5-yl)ethanol
InChI:
InChI=1S/C6H7ClN2O/c1-4(10)5-2-8-6(7)9-3-5/h2-4,10H,1H3
InChI Key:
FOCGRSGPIGTELP-UHFFFAOYSA-N
SMILES:
CC(c1cnc(nc1)Cl)O
Properties
Complexity:
104
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:
1
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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