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1-(Ethynylsulfonyl)-4-Methylbenzene
[CAS# 13894-21-8]

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Identification
Classification Chemical reagent >> Organic reagent >> Sulfone, sulfoxide compound
Name 1-(Ethynylsulfonyl)-4-Methylbenzene
Synonyms (p-toluenesulfonyl)ethyne; Ethynyl p-Tolyl Sulfone; ETHYNYLP-TOLYLSULFONE
Molecular Formula C9H8O2S
Molecular Weight 180.22
CAS Registry Number 13894-21-8
SMILES CC1=CC=C(C=C1)S(=O)(=O)C#C
InChI 1S/C9H8O2S/c1-3-12(10,11)9-6-4-8(2)5-7-9/h1,4-7H,2H3
InChIKey FTHKWIMQNXVEHW-UHFFFAOYSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
Boiling point 297.9±33.0°C at 760 mmHg (Cal.)
Flash point 155.6±18.1°C (Cal.)
Refractive index 1.553 (Cal.)
Safety Data
SDS Available
References
(1) Mitchell H. Weston, Katsumasa NakajimaPresent address: Novartis Pharmaceuticals Inc., 100 Technology Square, Cambridge MA 02139, USA. Fax: 617-871-7043; Tel: 617-871-7459; E-mail: katsumasa.nakajima@n ovartis.com, Masood Parvez and Thomas G. Back. Ring-expansion of tertiary cyclic α-vinylamines by tandem conjugate addition to (p-toluenesulfonyl)ethyne and formal 3-aza-Cope rearrangement, Chem. Commun., 2006, 0, 3903.
Market Analysis Reports
List of Reports Available for 1-(Ethynylsulfonyl)-4-Methylbenzene
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