AG00IC2R

70555-46-3 | 1H-Indole-3-carboxaldehyde, 6-methoxy-

AG00IC2R

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CAS Number	70555-46-3
Catalog Number	AG00IC2R(AGN-PC-0JXWJM)
Chemical Name	1H-Indole-3-carboxaldehyde, 6-methoxy-
IUPAC Name	6-methoxy-1H-indole-3-carbaldehyde
InChI	InChI=1S/C10H9NO2/c1-13-8-2-3-9-7(6-12)5-11-10(9)4-8/h2-6,11H,1H3
InChI Key	JTEFJNIWWXTBMP-UHFFFAOYSA-N
MDL Number	MFCD03848058
Molecular Formula	C10H9NO2
Molecular Weight	175.1840
SMILES	COC1=CC=C2C(=CNC2=C1)C=O
Synonyms	6-Methoxy-1H-indole-3-carbaldehyde, 70555-46-3, 6-Methoxyindole-3-carboxaldehyde, 6-methoxyindole-3-carbaldehyde, 1H-Indole-3-carboxaldehyde, 6-methoxy-, JTEFJNIWWXTBMP-UHFFFAOYSA-N, MFCD03848058, 6-methoxy-1H-indole-3-carboxaldehyde, AK-16447, ZERO/005142, PubChem7695, AC1LIMS5, AC1Q6QCP, 6-Methoxyindol-3-aldehyd, ACMC-209of6, MLS000559710, SCHEMBL671759, CHEMBL1378011, CTK5D2578, KS-00000IIM, DTXSID00358639, HMS2521K04, ZINC489118, ACN-S002824, ALBB-007658, BB_NC-00870, CS-B1235, ZX-AN007159, ZX-AT000358, ANW-35920, BBL013295, CM-698, FCH919767, OR1694, SBB005312, STK504690, AKOS000505606, 1H-Indole-3-carbaldehyde, 6-methoxy-, AB16817, AC-4752, MA-0823, MCULE-7063647573, RP10661, 1H-Indole-3-carboxaldehyde,6-methoxy-, AJ-23150, AN-11645, BAS 10142242, BC213340, CJ-04293, Q698, SC-06433, SMR000178705, SY056965, ZB014161, AB0017753, AX8017041, ST4105041, TR-023345, 4CH-009342, FT-0652209, ST24029795, MFCD03848058 (97%), B-3888, M70463, 6-Methoxy-1H-indole-3-carbaldehyde, AldrichCPR, 555M463, A836919, J-518832, C10H9NO2, AR-1H1972, CID907214, 71172-26-4,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.063g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	175.187g/mol
Monoisotopic Mass	175.063g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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