8-Chloroquinoline-2-carboxylic Acid - CAS 915922-73-5

Catalog:	BB040262
Product Name:	8-Chloroquinoline-2-carboxylic Acid
CAS:	915922-73-5
Synonyms:	8-chloro-2-quinolinecarboxylic acid; 8-chloroquinoline-2-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	8-chloroquinoline-2-carboxylic acid
Description:	8-Chloroquinoline-2-carboxylic Acid (CAS# 915922-73-5) is used to prepare imidazolinylnicotinic acids and esters and related compounds as herbicidal agents.
Molecular Weight:	207.61
Molecular Formula:	C10H6ClNO2
Canonical SMILES:	C1=CC2=C(C(=C1)Cl)N=C(C=C2)C(=O)O
InChI:	InChI=1S/C10H6ClNO2/c11-7-3-1-2-6-4-5-8(10(13)14)12-9(6)7/h1-5H,(H,13,14)
InChI Key:	BISKATAKTWFSQV-UHFFFAOYSA-N
Boiling Point:	382.1 °C at 760 mmHg
Density:	1.469 g/cm³
LogP:	2.58640

Publication Number	Title	Priority Date
RO-131025-A2	8-chloro-quinolin-carboxylic acid with antimicrobial activity and process for preparing the same	20141028
RO-131025-B1	8-chloro-quinolin-carboxylic acids with antimicrobial activity and process for preparing the same	20141028
AU-2010221417-A1	8-substituted quinolines and related analogs as sirtuin modulators	20090302
CA-2754058-A1	8-substituted quinolines and related analogs as sirtuin modulators	20090302
EP-2403833-A1	8-substituted quinolines and related analogs as sirtuin modulators	20090302

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Related Functional Groups

Carbonyl Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	234
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	207.0087061
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	207.0087061
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7