AG0028BK

202584-14-3 | 1H-Indole-3-carboxaldehyde, 1,6-dimethyl-

AG0028BK

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CAS Number	202584-14-3
Catalog Number	AG0028BK(AGN-PC-03RS1C)
Chemical Name	1H-Indole-3-carboxaldehyde, 1,6-dimethyl-
IUPAC Name	1,6-dimethylindole-3-carbaldehyde
InChI	InChI=1S/C11H11NO/c1-8-3-4-10-9(7-13)6-12(2)11(10)5-8/h3-7H,1-2H3
InChI Key	VFOVAOMIZCNUDY-UHFFFAOYSA-N
MDL Number	MFCD12026999
Molecular Formula	C11H11NO
Molecular Weight	173.2111
SMILES	O=CC1=CN(C)C2=C1C=CC(C)=C2
Synonyms	1,6-dimethyl-1H-indole-3-carbaldehyde, 202584-14-3, 1,6-dimethylindole-3-carbaldehyde, SCHEMBL2275824, CTK7I0188, DTXSID30626696, VFOVAOMIZCNUDY-UHFFFAOYSA-N, ALBB-005045, 0381AB, CD-869, MFCD12026999, STK501561, ZINC30714360, AKOS006316673, MCULE-3639837334, 1,6-dimethyl-1H-indole-3-carboxaldehyde, AJ-84150, SC-61774, 1H-Indole-3-carboxaldehyde,1,6-dimethyl-, AB0180747, TR-058568, 1H-Indole-3-carboxaldehyde, 1,6-dimethyl-, 4CH-022088, BB 0262352, ST24036897, C11H11NO, T2039,

Complexity	204
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	1.8

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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