Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate | CAS No. 82586-59-2

Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate

Basic Information

CAS Number

82586-59-2

Molecular Formula

C19H21NO4

Molecular Weight

327.38 g/mol

AD

Basic Physical Properties

Boiling Point

473.3°C at 760 mmHg

COC1=C(C=C2CNC(CC2=C1)C(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C19H21NO4/c1-22-17-9-14-8-16(20-11-15(14)10-18(17)23-2)19(21)24-12-13-6-4-3-5-7-13/h3-7,9-10,16,20H,8,11-12H2,1-2H3

InChIKey

BKYMGLDEHRTSOO-UHFFFAOYSA-N

LogP

2.4615

Topological Polar Surface Area

56.790000000000006 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

410

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • AB16478
  • Benzyl6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
  • A13897
  • Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
  • FT-0652354
  • 82586-59-2
  • SCHEMBL7225047
  • AKOS015912932
  • AC-11925
  • Benzyl 6,7-dimethoxy 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
  • DTXSID60516137
  • Q-103223
  • 3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, phenylmethyl ester, (3S)-
  • BENZYL 6,7-DIMETHOXY 1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLATE
  • (S)-1,2,3,4-Tetrahydro-6,7-dimethoxyisoquinoline-3-carboxylic acid benzyl ester
  • 3-Isoquinolinecarboxylicacid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, phenylmethyl ester, (S)-

MDL Number

MFCD03840630

FAQ

What regulatory guidelines apply to Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2)?

Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2) is subject to various regulatory guidelines including GHS for chemical classification and labeling, REACH for registration, evaluation, authorization, and restriction of chemicals, and FDA/EPA for safety and environmental standards. Detailed MSDS and regulatory documents should be consulted for specific requirements.

Are there alternatives to Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2) in synthesis?

Alternatives to Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2) in synthesis include similar compounds such as 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid and its derivatives. Other reagents like benzyl chlorides and carboxylic acids could be used as substitutes, depending on the specific synthetic route.

What is the market or research trend for Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2)?

Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2) shows increasing interest in pharmaceutical and medicinal chemistry research, particularly for its potential as a therapeutic agent. Market trends indicate growing demand in the development of new drugs and personalized medicine, with price trends reflecting increasing research investment and demand.

How should waste containing Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2) be handled?

Waste containing Benzyl 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate (CAS: 82586-59-2) should be collected in appropriate containers, labeled for hazardous waste, and disposed of through professional waste management services. Incineration is a common method, and environmental precautions include ensuring compliance with local regulations and minimizing environmental impact. Safe handling and disposal procedures should be followed to prevent contamination and ensure safety.

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