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88284-15-5

88284-15-5 | 3-Quinolinecarboxylic acid, 2-(pentyloxy)-

CAS No: 88284-15-5 Catalog No: AG004A8Y MDL No:MFCD20538078

Product Description

Catalog Number:
AG004A8Y
Chemical Name:
3-Quinolinecarboxylic acid, 2-(pentyloxy)-
CAS Number:
88284-15-5
Molecular Formula:
C15H17NO3
Molecular Weight:
259.3004
MDL Number:
MFCD20538078
IUPAC Name:
2-pentoxyquinoline-3-carboxylic acid
InChI:
InChI=1S/C15H17NO3/c1-2-3-6-9-19-14-12(15(17)18)10-11-7-4-5-8-13(11)16-14/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,17,18)
InChI Key:
BEBIDMZSEFSGBM-UHFFFAOYSA-N
SMILES:
CCCCCOc1nc2ccccc2cc1C(=O)O

Properties

Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.121g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.305g/mol
Monoisotopic Mass:
259.121g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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