Home Other Building Blocks 2-(TETRAHYDRO-2H-PYRAN-4-YL)PYRIMIDINE-5-CARBOXYLIC ACID

2-(TETRAHYDRO-2H-PYRAN-4-YL)PYRIMIDINE-5-CARBOXYLIC ACID

CAS No.:
1447607-07-9
Catalog Number:
AG01DYS5
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
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Product Description
Catalog Number:
AG01DYS5
Chemical Name:
2-(TETRAHYDRO-2H-PYRAN-4-YL)PYRIMIDINE-5-CARBOXYLIC ACID
CAS Number:
1447607-07-9
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD21218312
IUPAC Name:
2-(oxan-4-yl)pyrimidine-5-carboxylic acid
InChI:
InChI=1S/C10H12N2O3/c13-10(14)8-5-11-9(12-6-8)7-1-3-15-4-2-7/h5-7H,1-4H2,(H,13,14)
InChI Key:
WPCZMRHHJQFUIA-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(nc1)C1CCOCC1
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties