AG003JHX

5416-80-8 | 3-Formyl-2-Methylindole

AG003JHX

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CAS Number	5416-80-8
Catalog Number	AG003JHX(AGN-PC-0JLAYZ)
Chemical Name	3-Formyl-2-Methylindole
EC Number	226-512-6
IUPAC Name	2-methyl-1H-indole-3-carbaldehyde
InChI	InChI=1S/C10H9NO/c1-7-9(6-12)8-4-2-3-5-10(8)11-7/h2-6,11H,1H3
InChI Key	CYZIVXOEJNAIBS-UHFFFAOYSA-N
MDL Number	MFCD00012077
Molecular Formula	C10H9NO
Molecular Weight	159.1846
NSC Number	11895
SMILES	O=Cc1c2ccccc2([nH]c1C)
UNII	R0Y4EK4FX7
Synonyms	5416-80-8, 2-Methyl-1H-indole-3-carbaldehyde, 2-Methylindole-3-carboxaldehyde, 3-Formyl-2-methylindole, 2-Methyl-3-formylindole, 1H-Indole-3-carboxaldehyde, 2-methyl-, 2-methylindole-3-carbaldehyde, Indole-3-carboxaldehyde, 2-methyl-, UNII-R0Y4EK4FX7, R0Y4EK4FX7, CYZIVXOEJNAIBS-UHFFFAOYSA-N, 2-Methylindole-3-carboxaldehyde, 97+%, NSC11895, EINECS 226-512-6, NSC 11895, PubChem7437, zlchem 1339, ACMC-1APKW, AC1L2JDN, AC1Q6QD6, KSC271E8J, BIDD:GT0605, SCHEMBL248974, 2-Methyl-3-formyl-1H-indole, 3-Formyl-2-methyl-1H-indole, ARONIS016725, 2-Methyl-3-indolecarboxaldehyde, DTXSID1063853, CTK1H1284, KS-00000XDA, TOS-BB-0651, 2-Methyl-3-indolecarboxaldehyde;, ZLE0117, ZINC164956, ALBB-000205, BCP27593, EBD47803, KS-000049BE, ANW-31981, BBL012122, CM-496, MFCD00012077, NSC-11895, SBB015331, STK041022, 2-Methyl-1H-indole-3-carboxaldehyde, 2-Methyl-1H-indole-3-carbaldehyde #, AKOS000118949, 2-Methylindole-3-carboxaldehyde, 97%, CS-W007520, MCULE-4419027969, PS-3273, RP22274, RTC-010500, TRA0031400, VI30174, NCGC00335106-01, AC-23428, AJ-16331, AK-16445, BR-16445, CJ-02256, L310, SC-76858, SY018466, ZB008388, DB-021386, Indole-3-carboxaldehyde, 2-methyl- (8CI), TC-010500, TL8003556, AM20060663, FT-0613060, FT-0659582, M1485, ST24032500, ST45031080, MFCD00012077 (98%), A15638, M-7543, AB01327611-02, I01-2967, I10-0310, InChI=1/C10H9NO/c1-7-9(6-12)8-4-2-3-5-10(8)11-7/h2-6,11H,1H, C10H9NO, C10-H9-N-O, CID73166, AR-1F3283, 1H-Indole-3-carboxaldehyde, 2-methyl- (9CI), M-3999, 2-Methylindole-3-carboxaldehyde, 97% - 1G 1g, 5558-29-2, 625471-18-3,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.068g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	159.188g/mol
Monoisotopic Mass	159.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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