Cyclocreatine phosphate

Base Information

• Chemical Name: Cyclocreatine phosphate
• CAS No.: 61839-19-8
• Molecular Formula: C5H10 N3 O5 P
• Molecular Weight: 223.12
• UNII: 754W1VSR5W
• DSSTox Substance ID: DTXSID10977411
• Nikkaji Number: J545.182E
• Wikidata: Q82962578
• Mol file: 61839-19-8.mol

Synonyms:1-carboxymethyl-2-imino-3-phosphonoimidazolidine;1-carboxymethyl-2-iminophosphoimidazolidine;cyclocreatine phosphate;N-phosphorylcyclocreatine;phosphocyclocreatine

Chemical Property of Cyclocreatine phosphate

Chemical Property:

• Vapor Pressure: 1.41E-10mmHg at 25°C
• Boiling Point: 481°C at 760 mmHg
• Flash Point: 244.7°C
• PSA: 134.97000
• Density: 2.03g/cm³
• LogP: -1.30840
• XLogP3: -2.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 223.03580743
• Heavy Atom Count: 14
• Complexity: 313

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(C(=N)N1CC(=O)O)P(=O)(O)O