C24H33O5.C5H14NO

Base Information

• Chemical Name: C24H33O5.C5H14NO
• CAS No.: 4201-78-9
• Molecular Formula: C29H47NO6
• Molecular Weight: 505.68658
• DSSTox Substance ID: DTXSID20962151
• Mol file: 4201-78-9.mol

Synonyms:C24H33O5.C5H14NO;C24-H33-O5.C5-H14-N-O;DTXSID20962151;Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, (5.beta.)-3,7,12-trioxocholan-24-oate (salt);2-Hydroxy-N,N,N-trimethylethan-1-aminium 3,7,12-trioxocholan-24-oate

Chemical Property of C24H33O5.C5H14NO

Chemical Property:

• Melting Point: 196-198°
• PSA: 111.57000
• LogP: 2.42350
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 505.34033822
• Heavy Atom Count: 36
• Complexity: 797

Purity/Quality:

99% ^*data from raw suppliers

CHOLINE DEHYDROCHOLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCC(=O)[O-])C1CCC2C1(C(=O)CC3C2C(=O)CC4C3(CCC(=O)C4)C)C.C[N+](C)(C)CCO
• Isomeric SMILES: CC(CCC(=O)[O-])[C@H]1CC[C@@H]2C1(C(=O)C[C@H]3C2C(=O)CC4C3(CCC(=O)C4)C)C.C[N+](C)(C)CCO