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1385696-52-5 | 5-(Cyclobutylmethoxy)pyridine-3-carboxylic acid
CAS No: 1385696-52-5 Catalog No: AG01F9UB MDL No:
Product Description
Catalog Number:
AG01F9UB
Chemical Name:
5-(Cyclobutylmethoxy)pyridine-3-carboxylic acid
CAS Number:
1385696-52-5
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
IUPAC Name:
5-(cyclobutylmethoxy)pyridine-3-carboxylic acid
InChI:
InChI=1S/C11H13NO3/c13-11(14)9-4-10(6-12-5-9)15-7-8-2-1-3-8/h4-6,8H,1-3,7H2,(H,13,14)
InChI Key:
LQBIWCRYCSZYGQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1)OCC1CCC1
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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