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1006-24-2 | 2,4(1H,3H)-Pyrimidinedione, 3-ethyl-6-methyl-
CAS No: 1006-24-2 Catalog No: AG0002G6 MDL No:
Product Description
Catalog Number:
AG0002G6
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 3-ethyl-6-methyl-
CAS Number:
1006-24-2
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
IUPAC Name:
3-ethyl-6-methyl-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C7H10N2O2/c1-3-9-6(10)4-5(2)8-7(9)11/h4H,3H2,1-2H3,(H,8,11)
InChI Key:
VWPISPCRFQVXQX-UHFFFAOYSA-N
SMILES:
CCn1c(=O)cc([nH]c1=O)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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