5-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-


Chemical Name: 5-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-
CAS Number: 114527-54-7
Product Number: AG000EMP(AGN-PC-00OE98)
Synonyms:
MDL No:
Molecular Formula: C10H11NO2
Molecular Weight: 177.1998

Identification/Properties


Computed Properties
Molecular Weight:
177.203g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
177.079g/mol
Monoisotopic Mass:
177.079g/mol
Topological Polar Surface Area:
49.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
205
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301
Precautionary Statements:
P264-P270-P301+P310+P330-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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