Chemical Property of 3-Phenylpropyl isothiocyanate
Chemical Property:
- Vapor Pressure:0.00302mmHg at 25°C
- Refractive Index:1.5780
- Boiling Point:293.4 °C at 760 mmHg
- Flash Point:135.1 °C
- PSA：44.45000
- Density:0.99 g/cm3
- LogP:2.72200
- Sensitive.:Moisture Sensitive
- XLogP3:3.9
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:2
- Rotatable Bond Count:4
- Exact Mass:177.06122053
- Heavy Atom Count:12
- Complexity:155
- Purity/Quality:
-
99% *data from raw suppliers
3-PhenylpropylIsothiocyanate *data from reagent suppliers
Safty Information:
- Pictogram(s):
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.;
R34:Causes burns.;
- Hazard Codes:R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.;
R34:Causes burns.;
- Statements:
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.;
R34:Causes burns.;
- Safety Statements:
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.;
S36/37/39:Wear suitabl
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:C1=CC=C(C=C1)CCCN=C=S
-
Uses
3-Phenylpropyl isothiocyanate is an isothiocyanate inducer of phase II detoxifying enzymes.
