5-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic Acid

Base Information

• Chemical Name: 5-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic Acid
• CAS No.: 151637-59-1
• Molecular Formula: C11H13 N O2
• Molecular Weight: 191.23
• Hs Code.: 29334990
• DSSTox Substance ID: DTXSID70369914
• Nikkaji Number: J303.824F
• Mol file: 151637-59-1.mol

Synonyms:5-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic Acid;151637-59-1;DL-5-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID;SCHEMBL4478717;DTXSID70369914;QLFCCSYNIFSINY-UHFFFAOYSA-N;AKOS000279302;AKOS024015240;CS-0291763;EN300-398341;1,2,3,4-Tetrahydro-5-methylisoquinoline-3-carboxylic acid;5-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylicAcid;DL-5-Methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, AldrichCPR

Chemical Property of 5-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic Acid

Chemical Property:

• Vapor Pressure: 1.53E-06mmHg at 25°C
• Melting Point: 315.6-318.1 °C
• Refractive Index: 1.5220 (estimate)
• Boiling Point: 382.7°Cat760mmHg
• Flash Point: 185.3°C
• PSA: 49.33000
• Density: 1.189g/cm³
• LogP: 1.42270
• Storage Temp.: 0-6°C
• XLogP3: -1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 191.094628657
• Heavy Atom Count: 14
• Complexity: 229

Purity/Quality:

98%min ^*data from raw suppliers

DL-5-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2CC(NCC2=CC=C1)C(=O)O