Home Halogens 2-(1-chloroethyl)-6-methylpyrimidin-4-ol

2-(1-chloroethyl)-6-methylpyrimidin-4-ol

CAS No.:
1394040-96-0
Catalog Number:
AG019ZH0
Molecular Formula:
C7H9ClN2O
Molecular Weight:
172.6122
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Product Description
Catalog Number:
AG019ZH0
Chemical Name:
2-(1-chloroethyl)-6-methylpyrimidin-4-ol
CAS Number:
1394040-96-0
Molecular Formula:
C7H9ClN2O
Molecular Weight:
172.6122
MDL Number:
MFCD22375235
IUPAC Name:
2-(1-chloroethyl)-4-methyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C7H9ClN2O/c1-4-3-6(11)10-7(9-4)5(2)8/h3,5H,1-2H3,(H,9,10,11)
InChI Key:
DKGCWHLFPSBYOA-UHFFFAOYSA-N
SMILES:
Cc1cc(O)nc(n1)C(Cl)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.04g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.612g/mol
Monoisotopic Mass:
172.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties