333549

3-Bromocyclohexene

technical grade, 90%

• Synonym(s): 2-Cyclohexen-1-yl bromide
• Empirical Formula (Hill Notation): C₆H₉Br
• CAS Number: 1521-51-3
• Molecular Weight: 161.04
• Beilstein: 635953
• MDL number: MFCD00013775
• UNSPSC Code: 12352100
• PubChem Substance ID: 24860144
• NACRES: NA.22

Properties

• grade: technical grade
• Quality Level: 100
• Assay: 90%
• form: liquid
• refractive index: n20/D 1.528 (lit.)
• bp: 57-58 °C/12 mmHg (lit.)
• density: 1.4 g/mL at 25 °C (lit.)
• functional group: bromo
• storage temp.: −20°C
• SMILES string: BrC1CCCC=C1
• InChI: 1S/C6H9Br/c7-6-4-2-1-3-5-6/h2,4,6H,1,3,5H2
• InChI key: AJKDUJRRWLQXHM-UHFFFAOYSA-N

Description

Application

3-Bromocyclohexene was used in the synthesis of N-tert-butoxycarbonyl-O-cyclohexyl-L-tyrosine. It was also used in the synthesis of enantiopure cyclohexitols such as muco-quercitol, D-chiro-inocitol and allo-inocitol.

Safety Information

• Pictograms: GHS02,GHS07
• Signal Word: Warning
• Hazard Statements: H226,H315,H319,H335
• Precautionary Statements: P210 - P233 - P240 - P241 - P303 + P361 + P353 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 3
• Flash Point(F): 129.2 °F - closed cup
• Flash Point(C): 54 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves