2,2-Difluoropropane-1,3-diol

Base Information

• Chemical Name: 2,2-Difluoropropane-1,3-diol
• CAS No.: 428-63-7
• Molecular Formula: C3H6F2O2
• Molecular Weight: 112.076
• Hs Code.: 2905590090
• European Community (EC) Number: 807-402-2
• NSC Number: 32744
• DSSTox Substance ID: DTXSID20195487
• Wikidata: Q83068440
• Mol file: 428-63-7.mol

Synonyms:2,2-difluoropropane-1,3-diol;428-63-7;2,2-DIFLUORO-1,3-PROPANEDIOL;1,3-Propanediol, 2,2-difluoro-;MFCD16619633;C3H6F2O2;NSC32744;NSC 32744;SCHEMBL711852;AMY7075;DTXSID20195487;BBL101726;NSC-32744;STL555523;AKOS007930412;PB42807;AS-48669;SY026989;CS-0094694;EN300-153017;F52367;A900814;F8887-5540

Chemical Property of 2,2-Difluoropropane-1,3-diol

Chemical Property:

• Vapor Pressure: 0.00334mmHg at 25°C
• Melting Point: 52.53 °C
• Boiling Point: 250.9°C at 760 mmHg
• PKA: 13.24±0.10(Predicted)
• Flash Point: 105.5°C
• PSA: 40.46000
• Density: 1.334g/cm³
• LogP: -0.39370
• Storage Temp.: 2-8°C
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 112.03358575
• Heavy Atom Count: 7
• Complexity: 48.9

Purity/Quality:

98%, ^*data from raw suppliers

2,2-Difluoropropane-1,3-diol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(C(CO)(F)F)O