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1215727-89-1 | 2-Pyridinecarboxylic acid, 6-(cyclohexyloxy)-
CAS No: 1215727-89-1 Catalog No: AG0015AV MDL No:MFCD11100044
Product Description
Catalog Number:
AG0015AV
Chemical Name:
2-Pyridinecarboxylic acid, 6-(cyclohexyloxy)-
CAS Number:
1215727-89-1
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD11100044
IUPAC Name:
6-cyclohexyloxypyridine-2-carboxylic acid
InChI:
InChI=1S/C12H15NO3/c14-12(15)10-7-4-8-11(13-10)16-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,14,15)
InChI Key:
MKFYNAVRSMQWBY-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(n1)OC1CCCCC1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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