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119778-64-2 | 4-Quinolinecarboxylic acid, 2-cyclopropyl-
CAS No: 119778-64-2 Catalog No: AG000PNF MDL No:MFCD00178252
Product Description
Catalog Number:
AG000PNF
Chemical Name:
4-Quinolinecarboxylic acid, 2-cyclopropyl-
CAS Number:
119778-64-2
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
MDL Number:
MFCD00178252
IUPAC Name:
2-cyclopropylquinoline-4-carboxylic acid
InChI:
InChI=1S/C13H11NO2/c15-13(16)10-7-12(8-5-6-8)14-11-4-2-1-3-9(10)11/h1-4,7-8H,5-6H2,(H,15,16)
InChI Key:
HYOFXKNWXLKLSH-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(nc2c1cccc2)C1CC1
NSC Number:
122820
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.236g/mol
Monoisotopic Mass:
213.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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