AG000P9A

1196-69-6 | 1H-INDOLE-5-CARBALDEHYDE

AG000P9A

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CAS Number	1196-69-6
Catalog Number	AG000P9A(AGN-PC-0JTDS7)
Chemical Name	1H-INDOLE-5-CARBALDEHYDE
IUPAC Name	1H-indole-5-carbaldehyde
InChI	InChI=1S/C9H7NO/c11-6-7-1-2-9-8(5-7)3-4-10-9/h1-6,10H
InChI Key	ADZUEEUKBYCSEY-UHFFFAOYSA-N
MDL Number	MFCD02093664
Molecular Formula	C9H7NO
Molecular Weight	145.1580
SMILES	C(=O)c1cc2c(cc1)[nH]cc2
Synonyms	Indole-5-carboxaldehyde, 1196-69-6, 1H-Indole-5-carbaldehyde, 5-Formylindole, 1h-indole-5-carboxaldehyde, indole-5-carbaldehyde, Indole-5-aldehyde, MFCD02093664, CHEMBL3358223, ADZUEEUKBYCSEY-UHFFFAOYSA-N, Indole-5-carboxaldehyde (5-Formylindole), 5-Indolealdehyde, Indole-5-carboxaldehyde, 98+%, 5-formyl-indole, 5-Formyl indole, 5-indole aldehyde, zlchem 361, PubChem7172, 5-Formyl-1H-indole, Indole-5-carboaldehyde, indole 5-carboxaldehyde, AC1LBU4V, 1H-indol-5-carbaldehyde, ACMC-209a3m, AC1Q6PW1, SCHEMBL97208, 5-INDOLECARBOXALDEHYDE, 1H-Indole-5-carbaldehyde #, Indole-5-carboxaldehyde, 98%, ADZUEEUKBYCSEY-UHFFFAOYSA-, CTK0I2037, DTXSID20343325, ZLC0203, ACN-S002751, ACT03594, ALBB-004800, BCP27554, CS-D1053, KS-00000WX4, ZINC2389301, AN-678, ANW-17360, BBL008344, BDBM50037782, CI-065, HTS001432, SBB047518, STK501456, AKOS000121181, AB10798, F2137G1, MCULE-9257177939, PS-3327, RP01447, RTC-060172, TRA0069447, 6-Bromo-4-fluoroindole-3-carboxaldehyde, NCGC00188180-01, NCGC00188180-02, AC-27774, AJ-35565, AK-45714, BR-45714, CJ-08336, N497, SC-00552, SY014625, AB0015823, DB-031771, ST2415511, TC-060172, 4CH-015156, AM20060956, FT-0633462, FT-0656788, I0674, ST50823968, MFCD02093664 (95%), A-2619, I-2203, 82659-EP2289890A1, 82659-EP2298758A1, 82659-EP2298759A1, 82659-EP2305664A1, AB01320191-02, 196I696, I01-2969, I10-0374, F0001-0322, InChI=1/C9H7NO/c11-6-7-1-2-9-8(5-7)3-4-10-9/h1-6,10H, 1227564-14-8, C9H7NO, 1H-Indole-5-carboxaldehyde (9CI), CID589040, ZINC02389301, ACN-037763, Indole-5-carboxaldehyde, 98% - 1g 1g, A2487, 39890-95-4,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	145.053g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	145.161g/mol
Monoisotopic Mass	145.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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