Tilidine fumarate

Base Information

• Chemical Name: Tilidine fumarate
• CAS No.: 55567-81-2
• Molecular Formula: C21H27NO6
• Molecular Weight: 389.4422
• European Community (EC) Number: 259-711-1
• DSSTox Substance ID: DTXSID4021349

Synonyms:Tilidine fumarate;EINECS 259-711-1;ethyl (1S,2R)-2-(dimethylamino)-1-phenylcyclohex-3-ene-1-carboxylate (2E)-but-2-enedioate;55567-81-2;C17H23NO2.C4H4O4;3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, trans-(+-)-, (E)-2-butenedioate (1:1);C17-H23-N-O2.C4-H4-O4;SCHEMBL8892388;DTXSID4021349;Trans-(+-)-[2-(ethoxycarbonyl)-2-phenylcyclohex-5-enyl]dimethylammonium hydrogen fumarate;trans-(1)-(2-(Ethoxycarbonyl)-2-phenylcyclohex-5-enyl)dimethylammonium hydrogen fumarate;LS-7725;ethyl 2-(dimethylamino)-1-phenylcyclohex-3-ene-1-carboxylate but-2-enedioate

Chemical Property of Tilidine fumarate

Chemical Property:

• Vapor Pressure: 3.4E-05mmHg at 25°C
• Boiling Point: 354.2°Cat760mmHg
• Flash Point: 114°C
• PSA: 104.14000
• Density: g/cm³
• LogP: 2.47950
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 389.18383758
• Heavy Atom Count: 28
• Complexity: 477

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1(CCC=CC1N(C)C)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCOC(=O)[C@@]1(CCC=C[C@H]1N(C)C)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

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