AG00352J

479-59-4 | 2,3,6,7-Tetrahydro-1H,5H-benzo[ij]quinolizine

AG00352J

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CAS Number	479-59-4
Catalog Number	AG00352J(AGN-PC-0JL88E)
Chemical Name	2,3,6,7-Tetrahydro-1H,5H-benzo[ij]quinolizine
EC Number	207-535-0
IUPAC Name	1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene
InChI	InChI=1S/C12H15N/c1-4-10-6-2-8-13-9-3-7-11(5-1)12(10)13/h1,4-5H,2-3,6-9H2
InChI Key	DZFWNZJKBJOGFQ-UHFFFAOYSA-N
MDL Number	MFCD00006917
Molecular Formula	C12H15N
Molecular Weight	173.2542
NSC Number	82354
SMILES	C1CCN2CCCC3=C2C1=CC=C3
UNII	8ERL3KJ6GQ
Synonyms	Julolidine, 479-59-4, 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline, 2,3,6,7-Tetrahydro-1H,5H-benzo[ij]quinolizine, 1H,5H-Benzo[ij]quinolizine, 2,3,6,7-tetrahydro-, 2,3,6,7-Tetrahydro-1H,5H-benzo(ij)quinolizine, 2,3,6,7-Tetrahydro-1H,5H-benzo[i,j]quinolizine, UNII-8ERL3KJ6GQ, 8ERL3KJ6GQ, DZFWNZJKBJOGFQ-UHFFFAOYSA-N, MFCD00006917, J-1000, 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-, 2,3,6,7-Tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline, NSC82354, EINECS 207-535-0, Julolidine, 97%, NSC 82354, AC1Q1GLR, AC1L28YW, SCHEMBL60540, CHEMBL1899731, DTXSID0060060, CTK4J0513, ZINC3860540, ANW-41457, NSC-82354, SBB059364, AKOS005062871, DS-6638, FCH1117277, MCULE-6796315627, NCGC00188119-01, NCGC00188119-02, NCGC00188119-03, AC-11756, AJ-46015, AK130299, AN-45171, M595, SC-78843, AX8000852, FT-0627560, J0007, ST50406375, 2,6,7-Tetrahydro-1H,5H-benzo[ij]quinolizine, A18806, 1H,5H-Benzo[ij]quinolizine,2,3,6,7-tetrahydro-, 479J594, C-05745, S14-1204, 2,3,6,7-Tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline #, InChI=1/C12H15N/c1-4-10-6-2-8-13-9-3-7-11(5-1)12(10)13/h1,4-5H,2-3,6-9H, C12H15N, 1H, 2,3,6,7-tetrahydro-, Julolidine, 98% - 25G 25g, CID68069, AR-1D2196, C12-H15-N, 50687-63-3,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.12g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	173.259g/mol
Monoisotopic Mass	173.12g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	3.2A^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