1,1,4-Butanetriol

Base Information

• Chemical Name: 1,1,4-Butanetriol
• CAS No.: 44603-18-1
• Molecular Formula: C4H10O3
• Molecular Weight: 106.06
• Hs Code.: 2905499000
• DSSTox Substance ID: DTXSID10473403
• Nikkaji Number: J1.228.611B
• Wikidata: Q82302774
• Mol file: 44603-18-1.mol

Synonyms:1,1,4-Butanetriol;Butane-1,1,4-triol;44603-18-1;4-Butantriol;SCHEMBL599332;SCHEMBL2957713;DTXSID10473403;FT-0695264

Chemical Property of 1,1,4-Butanetriol

Chemical Property:

• Refractive Index: n20/D 1.473(lit.)
• Boiling Point: 204.03 °C at 760 mmHg
• Flash Point: 95.3 °C
• PSA: 60.69000
• Density: 1.213 g/cm³
• LogP: -1.27800
• Water Solubility.: at 25 deg C (mg/L): 1e+006
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 106.062994177
• Heavy Atom Count: 7
• Complexity: 35.9

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): 36/37/38:
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC(O)O)CO