3,4-Dihydro-6,7-dimethoxy-1-(p-methoxybenzyl)isoquinoline Hydrochloride - CAS 13233-00-6
Catalog: |
BB067449 |
Product Name: |
3,4-Dihydro-6,7-dimethoxy-1-(p-methoxybenzyl)isoquinoline Hydrochloride |
CAS: |
13233-00-6 |
Synonyms: |
3,4-Dihydro-6,7-dimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline Hydrochloride; 3,4-Dihydro-6,7-dimethoxy-1-(p-methoxybenzyl)isoquinoline Hydrochloride; 3,4-Dihydro-6,7-dimethoxy-1-[(4-methoxyphenyl)methyl]isoquinoline Hydrochloride |
IUPAC Name: | 6,7-dimethoxy-1-[(4-methoxyphenyl)methyl]-3,4-dihydroisoquinolinehydrochloride |
Description: | 3,4-Dihydro-6,7-dimethoxy-1-(p-methoxybenzyl)isoquinoline Hydrochloride is an intermediate in the synthesis of (-)-Higenamine (H325800). |
Molecular Weight: | 347.84 |
Molecular Formula: | C19H22ClNO3 |
Canonical SMILES: | COC1=CC=C(C=C1)CC2=NCCC3=CC(=C(C=C32)OC)OC.Cl |
InChI: | InChI=1S/C19H21NO3.ClH/c1-21-15-6-4-13(5-7-15)10-17-16-12-19(23-3)18(22-2)11-14(16)8-9-20-17/h4-7,11-12H,8-10H2,1-3H31H |
InChI Key: | MTBDPUSODLZRIK-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | -20°C, Hygroscopic |
References: | Lauer, A.M., et al. J. Am. Chem. Soc., 133, 9119 (2011); Burn, A.J., et al. J. Chem. Soc., 5532, (1961). |
Complexity: | 403 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 347.1288213 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 347.1288213 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 40Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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