AG001ZPQ

1745-07-9 | Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-

AG001ZPQ

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CAS Number	1745-07-9
Catalog Number	AG001ZPQ(AGN-PC-0JKCEH)
Chemical Name	Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-
IUPAC Name	6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
InChI	InChI=1S/C11H15NO2/c1-13-10-5-8-3-4-12-7-9(8)6-11(10)14-2/h5-6,12H,3-4,7H2,1-2H3
InChI Key	CEIXWJHURKEBMQ-UHFFFAOYSA-N
MDL Number	MFCD00777849
Molecular Formula	C11H15NO2
Molecular Weight	193.2423
SMILES	COC1=CC2=C(C=C1OC)CCNC2
Synonyms	6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, heliamine, heliamine monohydrochloride, 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline, 1745-07-9, Heliamine, 1,2,3,4-Tetrahydro-6,7-dimethoxyisoquinoline, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, BRN 0158809, CHEBI:5637, 6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline, 6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolinehydrochloride, Oprea1_719609, 5-21-04-00478 (Beilstein Handbook Reference), CHEMBL12367, SCHEMBL329913, AC1L26A9, AC1Q4F03, AC1Q4F04, KS-00001YVO, DTXSID70169835, CEIXWJHURKEBMQ-UHFFFAOYSA-N, HMS1719L18, HT706, 6,7-dimethoxytetrahydroisoquinoline, ACT10831, BCP27076, ZINC3881969, ANW-75144, BBL011893, MFCD00777849, SBB005551, STK802586, AKOS000270809, CS-W005976, MB01442, MCULE-9426863055, AC-12394, AJ-46656, AK-47941, BC204547, BR-47941, LS-85888, SC-44763, AB0022865, DB-043978, TC-163889, 4CH-006777, 6,7-dimethoxy-3,4-dihydro-1H-isoquinoline, BB 0258413, FT-0633815, ST24029570, ST45028651, W3810, 6,7-dimethoxy-1,2,3,4tetrahydroisoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-isoquinolin, A19572, C09460, D90101, S-4930, 1,2,3,4-Tetrahydro-6,7-dimethoxy-isoquinoline, 6,7-dimethoxy-1,2, 3,4-tetrahydroisoquinoline, 6,7-dimethoxy-1,2,3,4-tetra hydroisoquinoline, 6T-0892, CS-002/03852013, I14-16200, (+/-)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, F9995-0037, ISOQUINOLINE,1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline, AldrichCPR, 1745-07-9 6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline, 6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline; hydrochloride, InChI=1/C11H15NO2/c1-13-10-5-8-3-4-12-7-9(8)6-11(10)14-2/h5-6,12H,3-4,7H2,1-2H, C11H15NO2, CID15623, C11-H15-N-O2, ACN-043943, A11944, A13245, 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride, 2328-12-3,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.11g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	193.246g/mol
Monoisotopic Mass	193.11g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	30.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number