242837

2-Bromohexanoic acid

97%

• Synonym(s): 2-Bromocaproic acid
• Linear Formula: CH₃(CH₂)₃CHBrCOOH
• CAS Number: 616-05-7
• Molecular Weight: 195.05
• Beilstein: 1721762
• EC Number: 210-461-1
• MDL number: MFCD00004218
• UNSPSC Code: 12352100
• PubChem Substance ID: 24854586
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: 97%
• form: liquid
• refractive index: n20/D 1.472 (lit.)
• bp: 136-138 °C/18 mmHg (lit.)
• solubility: alcohol: soluble(lit.); diethyl ether: soluble(lit.)
• density: 1.37 g/mL at 25 °C (lit.)
• SMILES string: CCCCC(Br)C(O)=O
• InChI: 1S/C6H11BrO2/c1-2-3-4-5(7)6(8)9/h5H,2-4H2,1H3,(H,8,9)
• InChI key: HZTPKMIMXLTOSK-UHFFFAOYSA-N

Description

General description

The reaction of 2-bromohexanoic acid (2-bromocaproic acid) with 6-(5,6-dipentyl-1,2,4-triazin-3-yl)-2,2′-bipyridine and Cm(III) was studied.

Application

2-Bromohexanoic acid was used as an internal standard in the determination of trans,trans-muconic acid (t,t-MA) in urine by GC-MS method.

Safety Information

• Pictograms: GHS05,GHS07
• Signal Word: Danger
• Hazard Statements: H302 + H312 + H332 - H314
• Precautionary Statements: P261 - P280 - P301 + P312 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Oral - Eye Dam. 1 - Skin Corr. 1B
• Storage Class Code: 8A - Combustible, corrosive hazardous materials
• WGK: WGK 3
• Flash Point(F): 230.0 °F - closed cup
• Flash Point(C): 110 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves