AG003HN3

35308-68-0 | 2-Methyl-4,5,6,7-tetrahydro-1H-indol-4-one

AG003HN3

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CAS Number	35308-68-0
Catalog Number	AG003HN3(AGN-PC-0MTZ17)
Chemical Name	2-Methyl-4,5,6,7-tetrahydro-1H-indol-4-one
IUPAC Name	2-methyl-1,5,6,7-tetrahydroindol-4-one
InChI	InChI=1S/C9H11NO/c1-6-5-7-8(10-6)3-2-4-9(7)11/h5,10H,2-4H2,1H3
InChI Key	HJIYEKHYUGHTAC-UHFFFAOYSA-N
MDL Number	MFCD04972500
Molecular Formula	C9H11NO
Molecular Weight	149.1897
SMILES	CC1=CC2=C(CCCC2=O)N1
Synonyms	35308-68-0, 2-Methyl-4,5,6,7-tetrahydro-1H-indol-4-one, 1,5,6,7-Tetrahydro-2-methyl-4H-indol-4-one, 2-methyl-6,7-dihydro-1H-indol-4(5H)-one, 2-Methyl-4-oxo-4,5,6,7-tetrahydroindole, 4H-Indol-4-one, 1,5,6,7-tetrahydro-2-methyl-, ACMC-1AE11, SCHEMBL1052949, SCHEMBL6753719, CTK4H4216, HJIYEKHYUGHTAC-UHFFFAOYSA-, DTXSID20431115, HJIYEKHYUGHTAC-UHFFFAOYSA-N, ZINC2540011, 4392AB, ANW-28171, MFCD04972500, AKOS000320271, AB21142, AC-13113, AJ-38975, AS-43219, 2-Methyl-4,5,6,7-tetrahydroindol-4-one, 4-Oxo-2-methyl-4,5,6,7-tetrahydroindole, DB-069196, TC-070040, 2-methyl-1,5,6,7-tetrahydro-indol-4-one, FT-0649545, ST24040840, 2-methyl-1,5,6,7-tetrahydro-4H-indol-4-one, 308T680, 4H-Indol-4-one,1,5,6,7-tetrahydro-2-methyl-, I14-91495, 1,5,6,7-Tetrahydro-2-methyl-4H-indol-4-one, AldrichCPR, InChI=1/C9H11NO/c1-6-5-7-8(10-6)3-2-4-9(7)11/h5,10H,2-4H2,1H3, C9H11NO, CID9815223, 2-methyl-1,5,6,7-tetrahydroindol-4-one, T2376,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	149.084g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	149.193g/mol
Monoisotopic Mass	149.084g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	32.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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