Di-myo-inositol-1,1'-phosphate

Base Information

• Chemical Name: Di-myo-inositol-1,1'-phosphate
• CAS No.: 143491-08-1
• Molecular Formula: C12H23 O14 P
• Molecular Weight: 422.276381
• DSSTox Substance ID: DTXSID40931905
• Nikkaji Number: J977.618D
• Mol file: 143491-08-1.mol

Synonyms:di-myo-inositol-1,1'-phosphate;di-myoinositol-1,1'-phosphate;Ins-P-Ins

Chemical Property of Di-myo-inositol-1,1'-phosphate

Chemical Property:

• Vapor Pressure: 1.56E-19mmHg at 25°C
• Boiling Point: 648.1°Cat760mmHg
• Flash Point: 345.7°C
• PSA: 267.87000
• Density: 2.04g/cm³
• LogP: -6.50660
• XLogP3: -7.5
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 4
• Exact Mass: 422.08254240
• Heavy Atom Count: 27
• Complexity: 486

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(C(C(C(C(C1O)O)OP(=O)(O)OC2C(C(C(C(C2O)O)O)O)O)O)O)O
• Isomeric SMILES: [C@H]1([C@H](C([C@@H]([C@@H](C1O)O)O)OP(=O)(O)OC2[C@@H]([C@H](C([C@H]([C@H]2O)O)O)O)O)O)O