AG002EC0

19012-02-3 | 1-(1-Methyl-1h-indol-3-yl)ethanone

AG002EC0

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CAS Number	19012-02-3
Catalog Number	AG002EC0(AGN-PC-0JTGYK)
Chemical Name	1-(1-Methyl-1h-indol-3-yl)ethanone
IUPAC Name	1-(1-methylindol-3-yl)ethanone
InChI	InChI=1S/C11H11NO/c1-8(13)10-7-12(2)11-6-4-3-5-9(10)11/h3-7H,1-2H3
InChI Key	HYLFRICFKVJJOZ-UHFFFAOYSA-N
MDL Number	MFCD00540232
Molecular Formula	C11H11NO
Molecular Weight	173.2111
SMILES	CN1C=C(C(C)=O)C2=C1C=CC=C2
Synonyms	19012-02-3, 1-(1-Methyl-1H-indol-3-yl)ethanone, 3-acetyl-1-methylindole, 1-(1-Methyl-1H-indol-3-yl)-1-ethanone, 1-(1-methylindol-3-yl)ethanone, 1-(1-methyl-1H-indol-3-yl)ethan-1-one, 3-Acetyl-1-methyl-1H-indole, Ethanone, 1-(1-methyl-1H-indol-3-yl)-, 1-Methyl-3-acetylindole, HYLFRICFKVJJOZ-UHFFFAOYSA-N, 1-(1-methyl-1H-indol-3-yl)-ethanone, AC1LC4EO, AC1Q3YQM, 1-methyl-3-acetyl-indole, SCHEMBL1887873, CHEMBL4068840, HYLFRICFKVJJOZ-UHFFFAOYSA-, DTXSID80344055, ALBB-013246, KS-00000SS5, ZINC1400602, 6403AD, MFCD00540232, STL421255, AKOS000343625, ACN-052962, MCULE-8804639652, SB18089, 3-ACETYL-1-TRIDEUTEROMETHYLINDOLE, 1-(1-Methyl-1H-indol-3-yl)ethanone #, 62237-94-9, DA-43403, SC-70724, SY033964, 1-(1-Methyl-1H-indole-3-yl)-1-ethanone, BB 0217944, FT-0683676, R3391, EN300-65561, MFCD00540232 (95%), 8H-945, AK-830/40151729, A1-00379, I10-1196, 1-(1-methyl-1H-indol-3-yl)-1-ethanone, AldrichCPR, Z57070074, InChI=1/C11H11NO/c1-8(13)10-7-12(2)11-6-4-3-5-9(10)11/h3-7H,1-2H3, C11H11NO, CID594156, ZINC01400602, 69271-42-7, Propanoic acid, pentafluoro-, 4-[1-(2,2,3,3,3-pentafluoro-1-oxopropoxy)-2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl ester, QPR,

Complexity	214
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.084g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	173.215g/mol
Monoisotopic Mass	173.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	22A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code	UN 2811

Certificate of Analysis

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