4-Quinolinol, decahydro-4-ethynyl-2-methyl-1-pentyl-, benzoate (ester), hydrochloride, (2-alpha,4-alpha,4a-alpha,8a-beta)-

Base Information

• Chemical Name: 4-Quinolinol, decahydro-4-ethynyl-2-methyl-1-pentyl-, benzoate (ester), hydrochloride, (2-alpha,4-alpha,4a-alpha,8a-beta)-
• CAS No.: 110370-47-3
• Molecular Formula: C24H33 N O2 . Cl H
• Molecular Weight: 403.9853
• DSSTox Substance ID: DTXSID60149227

Synonyms:110370-47-3;4-Quinolinol, decahydro-4-ethynyl-2-methyl-1-pentyl-, benzoate (ester), hydrochloride, (2-alpha,4-alpha,4a-alpha,8a-beta)-;C24H38NO2.ClH;DTXSID60149227;C24-H38-N-O2.Cl-H;LS-142508

Chemical Property of 4-Quinolinol, decahydro-4-ethynyl-2-methyl-1-pentyl-, benzoate (ester), hydrochloride, (2-alpha,4-alpha,4a-alpha,8a-beta)-

Chemical Property:

• Vapor Pressure: 2.25E-08mmHg at 25°C
• Boiling Point: 452.4°C at 760 mmHg
• Flash Point: 124.9°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 403.2278070
• Heavy Atom Count: 28
• Complexity: 544

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCN1C(CC(C2C1CCCC2)(C#C)OC(=O)C3=CC=CC=C3)C.Cl
• Isomeric SMILES: CCCCCN1[C@@H](C[C@]([C@@H]2[C@@H]1CCCC2)(C#C)OC(=O)C3=CC=CC=C3)C.Cl

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