AG001XAP

16732-73-3 | 1H-​Indole-​2-​carboxylic acid, 6-​methoxy-

AG001XAP

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CAS Number	16732-73-3
Catalog Number	AG001XAP(AGN-PC-0JQTU4)
Chemical Name	1H-​Indole-​2-​carboxylic acid, 6-​methoxy-
IUPAC Name	6-methoxy-1H-indole-2-carboxylic acid
InChI	InChI=1S/C10H9NO3/c1-14-7-3-2-6-4-9(10(12)13)11-8(6)5-7/h2-5,11H,1H3,(H,12,13)
InChI Key	XNBGANWAZJWOHS-UHFFFAOYSA-N
MDL Number	MFCD01548823
Molecular Formula	C10H9NO3
Molecular Weight	191.1834
NSC Number	27988
SMILES	C(=O)(O)c1[nH]c2c(c1)ccc(c2)OC
Synonyms	6-Methoxyindole-2-carboxylic acid, 16732-73-3, 6-Methoxy-1H-indole-2-carboxylic acid, 1h-indole-2-carboxylic acid, 6-methoxy-, XNBGANWAZJWOHS-UHFFFAOYSA-N, MFCD01548823, BAS 06489245, NSC27988, PubChem1703, zlchem 1017, AC1L8YVC, AC1Q4EQJ, Oprea1_070191, SCHEMBL335655, CTK0H4256, KS-00000NHM, AKOS JY2082559, DTXSID10328449, ZLD0483, 6-Methoxindole-2-Carboxylic Acid, OTAVA-BB 1149688, HMS3446G14, ZINC489014, ACT02556, ALBB-006745, AN-282, ANW-50665, BBL020243, NSC-27988, SBB027659, STK500600, AKOS000300045, Indole-2-carboxylic acid, 6-methoxy-, AC-9837, AS-5463, AS02120, ASINEX-REAG BAS 06489245, CCG-139914, CM-1084, CS-W007863, LS20609, MCULE-9779495169, RD-0134, TRA0036417, VI30078, 6-methoxy-1 h-indole-2-carboxylic acid, 6-Methoxyindole-2-carboxylic acid, 95%, AJ-23148, AK-27758, BR-27758, N788, NA090024, SC-01589, 6-Methoxy-1H-indole-2-carboxylic acid #, AB0001744, AB1005673, DB-031805, ST2412427, TC-061134, 4CH-015482, AM20030122, BB 0237257, FT-0637414, ST50280163, EN300-15092, M-2389, 732M733, Q-101970, F2158-0744, Z361993804, null, C10H9NO3, 6-Methoxyindole-2-carboxylicacid, CID410327, methyl 6-bromo-1H-indole-2-carboxylate,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	191.186g/mol
Monoisotopic Mass	191.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	62.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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