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162284-62-0 | 2,4(1H,3H)-Pyrimidinedione, 6-(chloromethyl)-1,3-dimethyl-
CAS No: 162284-62-0 Catalog No: AG001SYK MDL No:MFCD08166704
Product Description
Catalog Number:
AG001SYK
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 6-(chloromethyl)-1,3-dimethyl-
CAS Number:
162284-62-0
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
MDL Number:
MFCD08166704
IUPAC Name:
6-(chloromethyl)-1,3-dimethylpyrimidine-2,4-dione
InChI:
InChI=1S/C7H9ClN2O2/c1-9-5(4-8)3-6(11)10(2)7(9)12/h3H,4H2,1-2H3
InChI Key:
AEIYRTHZNGTKQE-UHFFFAOYSA-N
SMILES:
ClCc1cc(=O)n(c(=O)n1C)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.611g/mol
Monoisotopic Mass:
188.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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