AG00EIV6

635-79-0 | 2-Methyl-quinoline-3-carboxylic acid

AG00EIV6

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CAS Number	635-79-0
Catalog Number	AG00EIV6(AGN-PC-0K5UEU)
Chemical Name	2-Methyl-quinoline-3-carboxylic acid
IUPAC Name	2-methylquinoline-3-carboxylic acid
InChI	InChI=1S/C11H9NO2/c1-7-9(11(13)14)6-8-4-2-3-5-10(8)12-7/h2-6H,1H3,(H,13,14)
InChI Key	WXYKQNAKEPRCGF-UHFFFAOYSA-N
MDL Number	MFCD00510998
Molecular Formula	C11H9NO2
Molecular Weight	187.1947
SMILES	O=C(C1=CC2=CC=CC=C2N=C1C)O
Synonyms	2-Methylquinoline-3-carboxylic acid, 635-79-0, 2-Methyl-quinoline-3-carboxylic acid, 2-methyl-3-quinolinecarboxylic acid, 3-QUINOLINECARBOXYLIC ACID, 2-METHYL-, MFCD00510998, SMR000126685, AC1Q2PET, AC1LS40R, Quinaldine-3-carboxylic acid, MLS000544928, SCHEMBL4302924, CHEMBL1720208, CTK2F8732, DTXSID60363244, WXYKQNAKEPRCGF-UHFFFAOYSA-N, HMS2313B07, QU014, ACT10294, KS-000030BX, ZINC1395212, ANW-61344, SBB039109, 3-Quinolinecarboxylicacid, 2-methyl-, AKOS000122478, AB06377, MCULE-1492762865, QC-3759, NCGC00325638-01, AJ-25573, AK-46901, AB0091307, DB-073354, TC-150089, FT-0753277, ST50146589, T6596, EN300-07174, M80343, 2 - Methyl - quinoline - 3 - carboxylic acid, AB00451975-09, 11T-0872, F1922-0028, ACN-S004921, CID1481999,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.063g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.198g/mol
Monoisotopic Mass	187.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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