Benzylisothiourea

CAS Registry Number®

621-85-2

CAS Name

Benzylisothiourea

Molecular Formula

C8H10N2S

Molecular Mass

166.24

Cite this Page

Benzylisothiourea.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=621-85-2 (retrieved 2025-01-03) (CAS RN: 621-85-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    103-104 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H10N2S/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10)

InChIKey

InChIKey=GTRLQRHWPXEBLF-UHFFFAOYSA-N

SMILES

C(SC(=N)N)C1=CC=CC=C1

Canonical SMILES

N=C(SCC=1C=CC=CC1)N

Other Names for this Substance

  • Carbamimidothioic acid, phenylmethyl ester
  • Pseudourea, 2-benzyl-2-thio-
  • Benzylthiopseudourea
  • S-Benzylisothiourea
  • S-Benzylthiourea

View All

Deleted or Replaced CAS Registry Numbers

32841-24-0, 45961-59-9, 45957-59-3, 53624-67-2, 855652-45-8, 161722-91-4

CAS INSIGHTSTM
A collage showcasing diverse technology, including gadgets, devices, and innovative tools in a vibrant arrangement.