(R)-(-)-1-(3-Methoxyphenyl)ethyl isothiocyanate

Base Information

• Chemical Name: (R)-(-)-1-(3-Methoxyphenyl)ethyl isothiocyanate
• CAS No.: 749261-39-0
• Molecular Formula: C10H11 N O S
• Molecular Weight: 193.26544
• DSSTox Substance ID: DTXSID00426983
• Mol file: 749261-39-0.mol

Synonyms:749261-39-0;(R)-(-)-1-(3-Methoxyphenyl)ethyl isothiocyanate;1-[(1R)-1-ISOTHIOCYANATOETHYL]-3-METHOXYBENZENE;SCHEMBL1551125;DTXSID00426983;AG-G-98288;Benzene,1-[(1R)-1-isothiocyanatoethyl]-3-methoxy-(9ci)

Chemical Property of (R)-(-)-1-(3-Methoxyphenyl)ethyl isothiocyanate

Chemical Property:

• Refractive Index: 1.5800
• PSA: 53.68000
• Density: 1.12
• LogP: 2.85900
• Sensitive.: Moisture Sensitive
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 193.05613515
• Heavy Atom Count: 13
• Complexity: 201

Purity/Quality:

99% ^*data from raw suppliers

(R)-(-)-1-(3-METHOXYPHENYL)ETHYL ISOTHIOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C1=CC(=CC=C1)OC)N=C=S
• Isomeric SMILES: C[C@H](C1=CC(=CC=C1)OC)N=C=S