AG001F43

1477-50-5 | 1H-Indole-2-carboxylic acid

AG001F43

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CAS Number	1477-50-5
Catalog Number	AG001F43(AGN-PC-07Y4O3)
Chemical Name	1H-Indole-2-carboxylic acid
EC Number	216-030-4
IUPAC Name	1H-indole-2-carboxylic acid
InChI	InChI=1S/C9H7NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-5,10H,(H,11,12)
InChI Key	HCUARRIEZVDMPT-UHFFFAOYSA-N
MDL Number	MFCD00005611
Molecular Formula	C9H7NO2
Molecular Weight	161.1574
NSC Number	16598
SMILES	OC(=O)C1=CC2=CC=CC=C2N1
Synonyms	indole-2-carboxylic acid, Indole-2-carboxylic acid, 1H-Indole-2-carboxylic acid, 1477-50-5, 2-Carboxyindole, 2-Indolecarboxylic acid, NSC 16598, Indol-2-Carboxylic Acid, MFCD00005611, 1H-Indolecarboxylic acid, EINECS 216-030-4, Indole-2-carboxylate, 2-INDOLYLFORMIC ACID, CHEMBL278390, HCUARRIEZVDMPT-UHFFFAOYSA-N, Indole-2-carboxylic acid, 99%, 1h-indol-2-carbons, carboxyindole, 2-Indolecarboxylate, indolecarboxylic acid, indole carboxylic acid, PubChem1690, 2-carboxy-1H-indole, 2-indolcarboxylic acid, Spectrum_001485, 2-indol carboxylic acid, SpecPlus_000676, 1H-Indole-2-carboxylic, AC1L2IWZ, AC1Q1HKL, Spectrum2_000021, Spectrum3_000943, Spectrum4_001042, Spectrum5_001735, ACMC-1BU3Q, 1H-2-indolecarboxylic acid, 1H-indole-2-carboxylicacid, AC1Q73TK, SCHEMBL1935, 2-Indolecarboxylicacid(Indole-2-carboxylicacid), 1H-indol-2-carboxylic acid, Oprea1_557882, KBioGR_001304, KBioSS_001965, KSC170A9B, MLS002207203, DivK1c_006772, SPECTRUM1502082, SPBio_000081, INDOLE-2-CARBOXLIC ACID, Jsp002764, 1H-indole-2-carbonsäure, 2-INDOLE CARBOXYLIC ACID, HCUARRIEZVDMPT-UHFFFAOYSA-, Indole-2-carboxylic acid, 98%, KBio1_001716, KBio2_001965, KBio2_004533, KBio2_007101, KBio3_002006, DTXSID20163782, HMS1921H22, ZINC145536, ACN-S002762, ACT06982, BCP00082, CS-M1850, NSC16598, STR02479, ANW-21089, BBL004548, BDBM50004955, CCG-39889, HTS006381, NSC-16598, SBB003953, STK001808, 1H-Indole-2-carboxylic acid (9CI), AKOS000121595, AB00454, AC-3062, CG-0515, MCULE-2072698467, RP02161, RTR-004253, SDCCGMLS-0065971.P001, TRA0068869, KS-000005V7, NCGC00094957-01, NCGC00094957-02, AJ-12530, AK-46085, AN-13377, BR-46085, LS-81439, SC-01199, SMR000112260, SY003715, TL806279, AB0008354, AB1001711, DB-011564, ST2408916, BB 0242376, FT-0627213, FT-0627228, FT-0651889, I0332, ST45028103, MFCD00005611 (98%), 77I505, B-7291, I-2300, AQ-776/40177767, SR-01000392684, I01-2956, SR-01000392684-1, F0451-0610, N-p-Chlorobenzyl-N',N'-dimethyl-N-[2-pyridyl]lethylenediamine, N-p-Chlorobenzyl-N',N'-dimethyl- N-[2-pyridyl]lethylenediamine, 1H-Indole-2-carboxylic acid; compound with 1H-indole-2-carboxylic acid, InChI=1/C9H7NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-5,10H,(H,11,12), Chloropyramine, 1H-Indol-2-carbonsaure, 1H-indole-2-carboxylate, C9H7NO2, C9-H7-N-O2, CID72899, AR-1C3592, A3232, Indole-2-carboxylic acid, 98% - 10G 10g, 6170-42-9, 117106-21-5, 137497-03-1, 1501-70-8, 3770-50-1, 40615-36-9, ICB,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.048g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	161.16g/mol
Monoisotopic Mass	161.048g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	53.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number