3-Chlorophenyl isothiocyanate , 98% , 2392-68-9

CAS NO.：2392-68-9

Empirical Formula: C7H4ClNS

Molecular Weight: 169.63

MDL number: MFCD00004805

EINECS: 627-851-6

PRODUCT Properties

• Boiling point: 249-250 °C
• Density: 1.292
• refractive index: 1.658-1.66
• Flash point: >110°C
• storage temp.: 2-8°C, stored under nitrogen
• form: liquid
• Specific Gravity: 1.292
• Appearance: Colorless to light yellow Liquid
• Water Solubility: 33.93mg/L(25 ºC)
• Sensitive: Moisture Sensitive
• BRN: 636856
• InChI: InChI=1S/C7H4ClNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
• InChIKey: WGXCKFMVBAOIFH-UHFFFAOYSA-N
• SMILES: C1(Cl)=CC=CC(N=C=S)=C1
• CAS DataBase Reference: 2392-68-9(CAS DataBase Reference)

Description and Uses

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

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302+H312+H332-H315-H319-H335
• Precautionary statements: P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
• Hazard Codes: T,Xn
• Risk Statements: 42-36/37/38-23/24/25-20/21/22
• Safety Statements: 45-36/37/39-26-37/39
• RIDADR: 2810
• WGK Germany: 3
• RTECS: NX8474500
• HazardClass: 8
• PackingGroup: III
• HS Code: 29309090
• Limited Quantities: 100ml (liquid) or 0.5 Kg (solid)
• Excepted Quantities: Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)