AG0007EV

10242-01-0 | 1H-Indole-3-carboxylic acid, 5-methoxy-

AG0007EV

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CAS Number	10242-01-0
Catalog Number	AG0007EV(AGN-PC-0JNVAY)
Chemical Name	1H-Indole-3-carboxylic acid, 5-methoxy-
IUPAC Name	5-methoxy-1H-indole-3-carboxylic acid
InChI	InChI=1S/C10H9NO3/c1-14-6-2-3-9-7(4-6)8(5-11-9)10(12)13/h2-5,11H,1H3,(H,12,13)
InChI Key	RVVSEZGJCOAUED-UHFFFAOYSA-N
MDL Number	MFCD03265451
Molecular Formula	C10H9NO3
Molecular Weight	191.1834
NSC Number	88877
SMILES	O=C(C1=CNC2=C1C=C(OC)C=C2)O
Synonyms	5-Methoxy-1H-indole-3-carboxylic acid, 10242-01-0, 5-Methoxyindole-3-carboxylic acid, 5-methoxy-3-indolecarboxylic acid, 5-methoxy-3-carboxyindole, 1H-INDOLE-3-CARBOXYLIC ACID, 5-METHOXY-, MFCD03265451, NSC88877, PubChem7984, zlchem 1276, AC1L60LV, AC1Q4F1M, AC1Q5UN0, SCHEMBL592889, CTK0I3423, DTXSID40293353, ZLE0051, RVVSEZGJCOAUED-UHFFFAOYSA-N, WT599, ACT03563, KS-00000G7E, ZINC1569527, ANW-48883, BBL010858, CM-233, NSC-88877, SBB066630, STK642188, AKOS000302731, AB13930, AC-6602, AN-9841, AS06059, CM13616, CS-W000793, FS-2267, LS20291, MCULE-8485866109, RP25083, TRA0076374, 1H-Indole-3-carboxylicacid, 5-methoxy-, AJ-27172, AK-30227, BC203550, BR-30227, SC-00109, AB0034456, AB1005672, DB-007077, ST2412062, TR-000606, 4CH-007290, FT-0080045, FT-0630300, M2438, ST50342017, X8613, EN300-71417, 5-methoxyindole-3-carboxylic acid, AldrichCPR, S-2551, 10242-01-0 5-methoxy-3-indolecarboxylic acid, 242M010, I10-0082, Q-101968, Z1171979216, 5-Methoxyindole-3-carboxylic acid; 5-Methoxy-1H-indole-3-carboxylic acid, 5-Methoxyindole-3-carboxylic acid[5-methoxy-1H-indazole-3-carboxylic acid], C10H9NO3, AR-1G8660, CID259191, 5-Methoxy-1H-indole-3-carboxylicacid, 102433-70-5, 91419-52-2,

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

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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