Benzilic acid, 3-quinuclidinyl ester, hydrochloride

Base Information

• Chemical Name: Benzilic acid, 3-quinuclidinyl ester, hydrochloride
• CAS No.: 13004-56-3
• Molecular Formula: C21H23 N O3 . Cl H
• Molecular Weight: 373.91
• DSSTox Substance ID: DTXSID00926574
• Mol file: 13004-56-3.mol

Synonyms:13004-56-3;CHEKB;HNB 3;Quinuclidyl benzylate hydrochloride;Benzilic acid, 3-quinuclidinyl ester, hydrochloride;3-Quinuclidinyl benzilate hydrochloride;3-Quinuclidinol, benzylate (ester), hydrochloride;DTXSID00926574;1-Azabicyclo(2.2.2)octan-3-ol, benzylate (ester), hydrochloride;Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 1-azabicyclo(2.2.2)oct-3-yl ester, HCl;1-Azabicyclo[2.2.2]octan-3-yl hydroxy(diphenyl)acetate--hydrogen chloride (1/1)

Chemical Property of Benzilic acid, 3-quinuclidinyl ester, hydrochloride

Chemical Property:

• Vapor Pressure: 1.75E-08mmHg at 25°C
• Boiling Point: 439°C at 760 mmHg
• Flash Point: 219.3°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 373.1444713
• Heavy Atom Count: 26
• Complexity: 442

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN2CCC1C(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.Cl