AG002J2E

207451-81-8 | Isoquinoline, 1,2,3,4-tetrahydro-7-methyl-

AG002J2E

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CAS Number	207451-81-8
Catalog Number	AG002J2E(AGN-PC-00O2BB)
Chemical Name	Isoquinoline, 1,2,3,4-tetrahydro-7-methyl-
IUPAC Name	7-methyl-1,2,3,4-tetrahydroisoquinoline
InChI	InChI=1S/C10H13N/c1-8-2-3-9-4-5-11-7-10(9)6-8/h2-3,6,11H,4-5,7H2,1H3
InChI Key	FCTMZZUXBMQAER-UHFFFAOYSA-N
MDL Number	MFCD03004622
Molecular Formula	C10H13N
Molecular Weight	147.2169
SMILES	CC1=CC=C2C(=C1)CNCC2
Synonyms	7-methyl-1,2,3,4-tetrahydroisoquinoline, 207451-81-8, 7-Methyl-1,2,3,4-tetrahydro-isoquinoline, CHEMBL26711, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-7-METHYL-, SCHEMBL3240344, DTXSID30550023, FCTMZZUXBMQAER-UHFFFAOYSA-N, KS-000019OA, ZINC5815118, ANW-50597, BDBM50072981, MFCD03004622, AKOS004121649, AB12958, CM-1686, QC-9404, RP21164, AJ-54899, AK-27238, AM803489, BR-27238, DS-11180, SC-34639, 1,2,3,4-Tetrahydro-7-methylisoquinoline, AB0023324, DB-066311, ST2412575, TR-009736, 4CH-012872, CS-0018990, FT-0648962, W4357, S-5739, J-519305, I14-18037, C10H13N, ACN-043931, 7-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride,

Complexity	133
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	1.9

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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