2-Isothiocyanato-1-methoxy-propane

Base Information

• Chemical Name: 2-Isothiocyanato-1-methoxy-propane
• CAS No.: 362601-74-9
• Molecular Formula: C5H9NOS
• Molecular Weight: 131.2
• Hs Code.: 2930909090
• European Community (EC) Number: 670-616-8
• DSSTox Substance ID: DTXSID20374851
• Mol file: 362601-74-9.mol

Synonyms:362601-74-9;2-Isothiocyanato-1-methoxy-propane;1-methoxy-prop-2-yl isothiocyanate;2-isothiocyanato-1-methoxypropane;1-methoxy-prop-2-ylisothiocyanate;1-Methoxy-2-isothiocyanato propane;SCHEMBL20167673;DTXSID20374851;HMS1782B14;MFCD03093788;AKOS000212558;AKOS017268988;FS-5821;FT-0644514;EN300-01263;A823179;Z56891385

Chemical Property of 2-Isothiocyanato-1-methoxy-propane

Chemical Property:

• Vapor Pressure: 1.13mmHg at 25°C
• Refractive Index: 1.477
• Boiling Point: 181.9 °C at 760 mmHg
• Flash Point: 63.8 °C
• PSA: 53.68000
• Density: 1 g/cm³
• LogP: 1.12410
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 131.04048508
• Heavy Atom Count: 8
• Complexity: 98.6

Purity/Quality:

98%min ^*data from raw suppliers

1-Methoxy-prop-2-ylIsothiocyanate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(COC)N=C=S