AG002F79

1914-02-9 | 3,3-Dimethylindoline

AG002F79

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CAS Number	1914-02-9
Catalog Number	AG002F79(AGN-PC-00GIQT)
Chemical Name	3,3-Dimethylindoline
IUPAC Name	3,3-dimethyl-1,2-dihydroindole
InChI	InChI=1S/C10H13N/c1-10(2)7-11-9-6-4-3-5-8(9)10/h3-6,11H,7H2,1-2H3
InChI Key	SRCCLYMWDRNUAF-UHFFFAOYSA-N
MDL Number	MFCD11847210
Molecular Formula	C10H13N
Molecular Weight	147.2169
SMILES	CC1(CNC2=CC=CC=C12)C
Synonyms	3,3-DIMETHYLINDOLINE, 1914-02-9, 3,3-DIMETHYL-2,3-DIHYDRO-1H-INDOLE, 1H-Indole, 2,3-dihydro-3,3-dimethyl-, 2,3-DIHYDRO-3,3-DIMETHYL-1H-INDOLE, 3-dimethylindoline, SCHEMBL1031209, KS-00000PNT, DTXSID00473018, SRCCLYMWDRNUAF-UHFFFAOYSA-N, MFCD11847210, ZINC36447886, AKOS006237207, DS-6539, MCULE-2994255357, PB13437, 1H-Indole,2,3-dihydro-3,3-dimethyl-, AJ-92875, AK139225, SC-31919, CS-0051621, A-1856, 3,3-dimethyl-1,2-dihydroindole, CID11804912,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	147.105g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	147.221g/mol
Monoisotopic Mass	147.105g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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

Lot Number