7-Bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride - CAS 848135-96-6

Catalog:	BB055445
Product Name:	7-Bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
CAS:	848135-96-6
Synonyms:	7-bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride; 7-Bromo-3-methyl-1,2,3,4-tetrahydro-isoquinoline hydrochloride; 7-bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline; hydrochloride; 7-BROMO-3-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINE HCL

Technical Data

IUPAC Name:	7-bromo-3-methyl-1,2,3,4-tetrahydroisoquinolinehydrochloride
Description:	7-Bromo-3-Methyl-1,2,3,4-Tetrahydroisoquinoline Hydrochloride (cas# 848135-96-6) is a useful research chemical for organic synthesis and other chemical processes·
Molecular Weight:	262·57
Molecular Formula:	C10H12NBr·HCl
Canonical SMILES:	CC1CC2=C(CN1)C=C(C=C2)Br.Cl
InChI:	InChI=1S/C10H12BrN.ClH/c1-7-4-8-2-3-10(11)5-9(8)6-12-7/h2-3,5,7,12H,4,6H2,1H31H
InChI Key:	WRVLUERSOKOVSZ-UHFFFAOYSA-N
References:	Grunewald, G· L·, et al·: Bioorg· Med· Chem·, 13, 1261 (2005); Zhang, C·, et al·: From PCT Int· Appl· (2010), WO 2010075270 A1 20100701.

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	260.99199
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	260.99199
Rotatable Bond Count:	0
Topological Polar Surface Area:	12Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0