AG000GP1

115662-09-4 | 1H,5H-Benzo[ij]quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-

AG000GP1

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CAS Number	115662-09-4
Catalog Number	AG000GP1(AGN-PC-0P7XB6)
Chemical Name	1H,5H-Benzo[ij]quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-
IUPAC Name	6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carbaldehyde
InChI	InChI=1S/C17H23NO2/c1-16(2)5-7-18-8-6-17(3,4)13-14(18)12(16)9-11(10-19)15(13)20/h9-10,20H,5-8H2,1-4H3
InChI Key	ZBVWJSQPIHQKQJ-UHFFFAOYSA-N
MDL Number	MFCD00142785
Molecular Formula	C17H23NO2
Molecular Weight	273.3700
SMILES	O=CC1=C(O)C2=C3C(C(C)(C)CCN3CCC2(C)C)=C1
Synonyms	115662-09-4, 8-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde, 9-Formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine, 8-HYDROXY-1,1,7,7-TETRAMETHYL-2,3,6,7-TETRAHYDRO-1H,5H-PYRIDO[3,2,1-IJ]QUINOLINE-9-CARBALDEHYDE, 1,1,7,7-Tetramethyl-8-hydroxy-9-formyljulolidine, AK-24782, 8-Hydroxy-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydro-pyrido[3,2,1-ij]quinoline-9-carbaldehyde, 8-hydroxy-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-carbaldehyde, 8-HYDROXY-1,1,7,7-TETRAMETHYL-2,3,6,7-TETRAHYDRO-1H,5H-PYRIDO[3,2,1-IJ]QUINOLINE-9-CARBOXALDEHYDE, ZBVWJSQPIHQKQJ-UHFFFAOYSA-N, AC1LEJKJ, PubChem13976, SCHEMBL1165341, Jsp001137, CTK7H9089, KS-00000IBW, DTXSID60353165, ZINC163948, ACT03111, ZX-AT027878, ANW-43526, CF0038, CH-668, MFCD00142785, SBB063835, AKOS015889789, CS-W008423, OR28144, QC-1336, RP29686, TRA0073239, AJ-16084, AN-33064, AS-15869, BP-12462, BR-24782, ZB008058, AB0004781, AX8016754, RT-010916, FT-0630077, ST24030025, ST50307629, S-3677, 1,1,7,7-Tetrametyl-8-hydroxy-9-formyljulolidine, 662H094, C-17233, I01-3052, J-519440, 8-hydroxy-1,1,7,7-tetramethyljulolidine-9- carboxaldehyde, 1,1,7,7-Tetramethyl-10-hydroxy-2,3,5,6-tetrahydro-1H-benzo[ij]quinolizine-9-carbaldehyde, 1H,5H-benzo[ij]quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-, 1H,5H-benzo[ij]quinolizine-9-carboxaldehyde,2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-, 2,3,6,7-Tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-1H,5H-benzo[ij]quinolizine-9-carboxaldehyde, 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0^{5,13]trideca-5,7,9(13)-triene-7-carbaldehyde, 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-triene-7-carbaldehyde, 8-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0?,(1)(3)]trideca-5,7,9(13)-triene-7-carbaldehyde, C17H23NO2, CID737089, ZINC00163948, R183, H1315,

Complexity	404
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	273.173g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	273.376g/mol
Monoisotopic Mass	273.173g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number