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93005-16-4 | 2-pentylquinoline
CAS No: 93005-16-4 Catalog No: AG0066VC MDL No:
Product Description
Catalog Number:
AG0066VC
Chemical Name:
2-pentylquinoline
CAS Number:
93005-16-4
Molecular Formula:
C14H17N
Molecular Weight:
199.2915
IUPAC Name:
2-pentylquinoline
InChI:
InChI=1S/C14H17N/c1-2-3-4-8-13-11-10-12-7-5-6-9-14(12)15-13/h5-7,9-11H,2-4,8H2,1H3
InChI Key:
GMTGCIAJHZEUNB-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc2c(n1)cccc2
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.297g/mol
Monoisotopic Mass:
199.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Synthesis and biological evaluation of substituted quinolines: potential treatment of protozoal and retroviral co-infections. | Bioorganic & medicinal chemistry 20031117 |
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