Product Name

  • Name

    2-BENZYL-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID

  • EINECS
  • CAS No. 54329-48-5
  • Density 1.227g/cm3
  • Solubility
  • Melting Point
  • Formula C17H17NO2
  • Boiling Point 438.571°C at 760 mmHg
  • Molecular Weight 267.327
  • Flash Point 219.04°C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 54329-48-5 (2-BENZYL-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID)
  • Hazard Symbols
  • Synonyms 2-BENZYL-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID HYDROCHLORIDE;2-BENZYL-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID
  • PSA 40.54000
  • LogP 2.63600

2-Benzyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Chemical Properties

Molecular structure of 2-Benzyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid (CAS NO.54329-48-5) is:

Product Name: 2-Benzyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
CAS Registry Number: 54329-48-5
IUPAC Name: 2-Benzyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Molecular Weight: 267.32238 [g/mol]  
Molecular Formula: C17H17NO2  
XLogP3-AA: 0.6  
H-Bond Donor: 1  
H-Bond Acceptor: 3
Index of Refraction: 1.627 
Molar Refractivity: 77.267 cm3 
Molar Volume: 217.875 cm3
Surface Tension: 54.872 dyne/cm 
Density: 1.227 g/cm3 
Flash Point: 219.04 °C 
Enthalpy of Vaporization: 73.293 kJ/mol 
Boiling Point: 438.571 °C at 760 mmHg 
Canonical SMILES: C1C(N(CC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)O
InChI: InChI=1S/C17H17NO2/c19-17(20)16-10-14-8-4-5-9-15(14)12-18(16)11-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,19,20) 
InChIKey: XAUPAEYPYJHZCK-UHFFFAOYSA-N

2-Benzyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Specification

 2-Benzyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid , its cas register number is 54329-48-5. It also can be called 2-Benzyl-1,2,3,4-Tetrahydro-Isoquinoline-3-Carboxylic Acid .

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