253766

3-Chlorophenyl isothiocyanate

98%

• Fórmula lineal: ClC₆H₄NCS
• Número de CAS: 2392-68-9
• Peso molecular: 169.63
• MDL number: MFCD00004805
• UNSPSC Code: 12352100
• PubChem Substance ID: 24855326
• NACRES: NA.22

Propiedades

• assay: 98%
• form: liquid
• refractive index: n20/D 1.6585 (lit.)
• bp: 249-250 °C (lit.)
• density: 1.292 g/mL at 25 °C (lit.)
• functional group: chloro; isothiocyanate
• SMILES string: Clc1cccc(c1)N=C=S
• InChI: 1S/C7H4ClNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
• InChI key: WGXCKFMVBAOIFH-UHFFFAOYSA-N

Descripción

Application

3-Chlorophenyl isothiocyanate has been used in the synthesis of:

• 2-[(3-chlorophenyl)amino]naphtho[2,1-b]furo-5H-[3,2-d][1,3,4]thiadiazolo[3,2-i]pyrimidin-5-one
• (S)-N-[3-{N-(3-chlorophenyl)-4-(3-fluorophenyl)piperazine]-1-carbothioamido}-2-oxooxazolidin-5-yl)methyl]acetamide

Información de seguridad

• pictograms: GHS07
• signalword: Warning
• hcodes: H302 + H312 + H332,H315,H319,H335
• pcodes: P261 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• wgk_germany: WGK 3
• flash_point_f: 235.4 °F - closed cup
• flash_point_c: 113 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter