4-Cyanophenyl dihydrogen phosphate

Base Information

• Chemical Name: 4-Cyanophenyl dihydrogen phosphate
• CAS No.: 102153-74-2
• Molecular Formula: C7H6NO4P
• Molecular Weight: 199.10100
• DSSTox Substance ID: DTXSID70598287
• Nikkaji Number: J677.404K
• Wikidata: Q82494029
• Mol file: 102153-74-2.mol

Synonyms:102153-74-2;4-Cyanophenyl dihydrogen phosphate;SCHEMBL8055795;DTXSID70598287

Chemical Property of 4-Cyanophenyl dihydrogen phosphate

Chemical Property:

• Boiling Point: 440.9±47.0 °C(Predicted)
• PSA: 100.36000
• Density: 1.56±0.1 g/cm3(Predicted)
• LogP: 1.02978
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 199.00344467
• Heavy Atom Count: 13
• Complexity: 257

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C#N)OP(=O)(O)O

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