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1402232-52-3

1402232-52-3 | 2-(Cyclobutylmethoxy)pyrimidine-5-carboxylic acid

CAS No: 1402232-52-3 Catalog No: AG01F9AG MDL No:

Product Description

Catalog Number:
AG01F9AG
Chemical Name:
2-(Cyclobutylmethoxy)pyrimidine-5-carboxylic acid
CAS Number:
1402232-52-3
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
IUPAC Name:
2-(cyclobutylmethoxy)pyrimidine-5-carboxylic acid
InChI:
InChI=1S/C10H12N2O3/c13-9(14)8-4-11-10(12-5-8)15-6-7-2-1-3-7/h4-5,7H,1-3,6H2,(H,13,14)
InChI Key:
PQKXXSYXRFVFNK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(nc1)OCC1CCC1

Properties

Complexity:
223  
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:
4  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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