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130278-38-5

130278-38-5 | 2,4(1H,3H)-Pyrimidinedione, 1-(2-oxo-2-phenylethyl)-

CAS No: 130278-38-5 Catalog No: AG000U75 MDL No:

Product Description

Catalog Number:
AG000U75
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 1-(2-oxo-2-phenylethyl)-
CAS Number:
130278-38-5
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
IUPAC Name:
1-phenacylpyrimidine-2,4-dione
InChI:
InChI=1S/C12H10N2O3/c15-10(9-4-2-1-3-5-9)8-14-7-6-11(16)13-12(14)17/h1-7H,8H2,(H,13,16,17)
InChI Key:
OMGJBMXWULADKI-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Cn1ccc(=O)[nH]c1=O

Properties

Complexity:
370  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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