Home Carboxys 2-(2-methoxyphenyl)pyrimidine-5-carboxylic acid

2-(2-methoxyphenyl)pyrimidine-5-carboxylic acid

CAS No.:
1068977-12-7
Catalog Number:
AG00HAVZ
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
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Product Description
Catalog Number:
AG00HAVZ
Chemical Name:
2-(2-methoxyphenyl)pyrimidine-5-carboxylic acid
CAS Number:
1068977-12-7
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
MDL Number:
MFCD17530621
IUPAC Name:
2-(2-methoxyphenyl)pyrimidine-5-carboxylic acid
InChI:
InChI=1S/C12H10N2O3/c1-17-10-5-3-2-4-9(10)11-13-6-8(7-14-11)12(15)16/h2-7H,1H3,(H,15,16)
InChI Key:
WXUZXIHOKLVGET-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1ncc(cn1)C(=O)O
Properties
Complexity:
265  
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:
5  
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:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties