Hydroxyproline

Base Information

• Chemical Name: Hydroxyproline
• CAS No.: 6912-67-0
• Deprecated CAS: 138-46-5,17210-41-2,21105-75-9,24784-87-0,54733-36-7
• Molecular Formula: C5H9NO3
• Molecular Weight: 131.13
• European Community (EC) Number: 200-091-9
• NSC Number: 46704
• UNII: RMB44WO89X
• DSSTox Substance ID: DTXSID10883225
• Nikkaji Number: J148.015D
• Wikipedia: Hydroxyproline
• Wikidata: Q12460151
• NCI Thesaurus Code: C76144
• RXCUI: 1311548
• Metabolomics Workbench ID: 73611
• ChEMBL ID: CHEMBL352418
• Mol file: 6912-67-0.mol

Synonyms:N-methyl-trans-4-hydroxy-L-proline;NMH-Pro;trans-4-hydroxy-L-proline

Chemical Property of Hydroxyproline

Chemical Property:

• Boiling Point: 355.2±42.0 °C(Predicted)
• PKA: 2.14±0.40(Predicted)
• PSA: 0.00000
• Density: 1.395±0.06 g/cm3(Predicted)
• LogP: 0.00000
• XLogP3: -3.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 131.058243149
• Heavy Atom Count: 9
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Chemical Classes: Biological Agents -> Amino Acids and Derivatives
• Canonical SMILES: C1C(CNC1C(=O)O)O
• Isomeric SMILES: C1[C@H](CN[C@@H]1C(=O)O)O