naphthalen-2-yl [(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate

Base Information

• Chemical Name: naphthalen-2-yl [(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate
• CAS No.: 137888-44-9
• Molecular Formula: C16H19O9P
• Molecular Weight: 386.29
• DSSTox Substance ID: DTXSID20929926
• Mol file: 137888-44-9.mol

Synonyms:2-naphthyl-myo-inositol 1-phosphate;2-NMIP

Chemical Property of naphthalen-2-yl [(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate

Chemical Property:

• Vapor Pressure: 2.94E-15mmHg at 25°C
• Refractive Index: 1.706
• Boiling Point: 600.3°Cat760mmHg
• Flash Point: 316.8°C
• PSA: 166.72000
• Density: 1.68g/cm³
• LogP: -0.47770
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 4
• Exact Mass: 386.07666918
• Heavy Atom Count: 26
• Complexity: 516

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C=C(C=CC2=C1)OP(=O)(O)OC3C(C(C(C(C3O)O)O)O)O
• Isomeric SMILES: C1=CC=C2C=C(C=CC2=C1)OP(=O)(O)OC3[C@H]([C@H](C([C@H]([C@@H]3O)O)O)O)O