Chemical Property of Butin
Chemical Property:
- Vapor Pressure:3.68E-14mmHg at 25°C
- Melting Point:224-226ºC
- Refractive Index:1.692
- Boiling Point:582.4 °C at 760 mmHg
- PKA:7.69±0.40(Predicted)
- Flash Point:226.7 °C
- PSA:86.99000
- Density:1.485 g/cm3
- LogP:2.50990
- Storage Temp.:2-8°C
- XLogP3:1.8
- Hydrogen Bond Donor Count:3
- Hydrogen Bond Acceptor Count:5
- Rotatable Bond Count:1
- Exact Mass:272.06847348
- Heavy Atom Count:20
- Complexity:371
- Purity/Quality:
-
≥98% *data from raw suppliers
(-)-Butin 95+% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:C1C(OC2=C(C1=O)C=CC(=C2)O)C3=CC(=C(C=C3)O)O
- Isomeric SMILES:C1[C@H](OC2=C(C1=O)C=CC(=C2)O)C3=CC(=C(C=C3)O)O