tert-Butyl chlorothioformate

CAS Registry Number®

13889-95-7

CAS Name

tert-Butyl chlorothioformate

Molecular Formula

C5H9ClOS

Molecular Mass

152.64

Cite this Page

tert-Butyl chlorothioformate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13889-95-7 (retrieved 2024-11-22) (CAS RN: 13889-95-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    48-49 °C @ Press: 14 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5H9ClOS/c1-5(2,3)8-4(6)7/h1-3H3

InChIKey

InChIKey=IFVLGABUISIOQQ-UHFFFAOYSA-N

SMILES

S(C(C)(C)C)C(Cl)=O

Canonical SMILES

O=C(Cl)SC(C)(C)C

Other Names for this Substance

  • Carbonochloridothioic acid, S-(1,1-dimethylethyl) ester
  • Formic acid, chlorothio-, S-tert-butyl ester
  • tert-Butyl chlorothioformate
  • S-tert-Butyl chlorothioformate
  • (tert-Butylsulfanyl)(chloro)methanone

Deleted or Replaced CAS Registry Numbers

1082068-77-6

CAS INSIGHTSTM
Hourglass and a clock