Home Carboxys 2-Pyrimidinecarboxylic acid, 5-hydroxy-, ethyl ester

2-Pyrimidinecarboxylic acid, 5-hydroxy-, ethyl ester

CAS No.:
1240622-58-5
Catalog Number:
AG000LIK
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
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Product Description
Catalog Number:
AG000LIK
Chemical Name:
2-Pyrimidinecarboxylic acid, 5-hydroxy-, ethyl ester
CAS Number:
1240622-58-5
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD16988311
IUPAC Name:
ethyl 5-hydroxypyrimidine-2-carboxylate
InChI:
InChI=1S/C7H8N2O3/c1-2-12-7(11)6-8-3-5(10)4-9-6/h3-4,10H,2H2,1H3
InChI Key:
HXPCNJRSHKYNFO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ncc(cn1)O
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties