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14383-43-8

14383-43-8 | 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-2,6-dioxo-

CAS No: 14383-43-8 Catalog No: AG001IGG MDL No:MFCD06357897

Product Description

Catalog Number:
AG001IGG
Chemical Name:
1(2H)-Pyrimidineacetic acid, 3,6-dihydro-2,6-dioxo-
CAS Number:
14383-43-8
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
MDL Number:
MFCD06357897
IUPAC Name:
2-(2,4-dioxo-1H-pyrimidin-3-yl)acetic acid
InChI:
InChI=1S/C6H6N2O4/c9-4-1-2-7-6(12)8(4)3-5(10)11/h1-2H,3H2,(H,7,12)(H,10,11)
InChI Key:
QFUOATLPSKJDGL-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1c(=O)cc[nH]c1=O

Properties

Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.124g/mol
Monoisotopic Mass:
170.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2  

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