(R)-1-Phenylethyl isothiocyanate

CAS Registry Number®

24277-44-9

CAS Name

(R)-1-Phenylethyl isothiocyanate

Molecular Formula

C9H9NS

Molecular Mass

163.24

Cite this Page

(R)-1-Phenylethyl isothiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=24277-44-9 (retrieved 2024-11-25) (CAS RN: 24277-44-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    121 °C @ Press: 10 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NS/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3/t8-/m1/s1

InChIKey

InChIKey=QQCJPTVZIZVKEZ-MRVPVSSYSA-N

SMILES

[C@@H](N=C=S)(C)C1=CC=CC=C1

Canonical SMILES

S=C=NC(C=1C=CC=CC1)C

Other Names for this Substance

  • Benzene, [(1R)-1-isothiocyanatoethyl]-
  • Isothiocyanic acid, α-methylbenzyl ester, (R)-(-)-
  • Benzene, (1-isothiocyanatoethyl)-, (R)-
  • [(1R)-1-Isothiocyanatoethyl]benzene
  • (R)-1-Phenylethyl isothiocyanate

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