AG00ELEM

59394-30-8 | 6-Chloroquinoline-2-carboxylic acid

AG00ELEM

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CAS Number	59394-30-8
Catalog Number	AG00ELEM(AGN-PC-0WABYE)
Chemical Name	6-Chloroquinoline-2-carboxylic acid
IUPAC Name	6-chloroquinoline-2-carboxylic acid
InChI	InChI=1S/C10H6ClNO2/c11-7-2-4-8-6(5-7)1-3-9(12-8)10(13)14/h1-5H,(H,13,14)
InChI Key	UKMWQYNJAVNCOZ-UHFFFAOYSA-N
MDL Number	MFCD09834123
Molecular Formula	C10H6ClNO2
Molecular Weight	207.6131
SMILES	O=C(C1=NC2=CC=C(Cl)C=C2C=C1)O
Synonyms	6-CHLOROQUINOLINE-2-CARBOXYLIC ACID, 59394-30-8, 6-CHLORO-2-QUINOLINECARBOXYLIC ACID, SCHEMBL740617, CTK1E7465, DTXSID50489164, UKMWQYNJAVNCOZ-UHFFFAOYSA-N, ACT09886, MFCD09834123, ZINC20272701, AKOS000320312, 2-Quinolinecarboxylic acid, 6-chloro-, AB52747, AK205394, AS-35584, SC-68521, AB0049138, W-4244, 6-CHLOROQUINOLINE-2-CARBOXYLICACID,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.009g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.613g/mol
Monoisotopic Mass	207.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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