Pyrrolidinocholine

Base Information

• Chemical Name: Pyrrolidinocholine
• CAS No.: 45651-66-9
• Molecular Formula: C7H16NO+
• Molecular Weight: 130.2075
• DSSTox Substance ID: DTXSID00196578
• Nikkaji Number: J395.123E
• Wikidata: Q83069606
• ChEMBL ID: CHEMBL1184129
• Mol file: 45651-66-9.mol

Synonyms:N-hydroxyethylpyrrolidinium methiodide;pyrrolcholine;pyrrolcholine iodide;pyrrolidinecholine;pyrrolidinocholine

Chemical Property of Pyrrolidinocholine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 20.23000
• Density: g/cm³
• LogP: 0.17790
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 130.123189134
• Heavy Atom Count: 9
• Complexity: 86.9

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+]1(CCCC1)CCO