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Ethyl 7-bromoheptanoate

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Ethyl 7-bromoheptanoate Basic information

Product Name:
Ethyl 7-bromoheptanoate
Synonyms:
  • Ethyl 7-bromoheptanoate 97%
  • CHEMPACIFIC 43805
  • ETHYL W-BROMOHEPTANOATE
  • ETHYL 7-BROMOHEPTANOATE
  • 7-BROMOHEPTANOIC ACID ETHYL ESTER
  • 7-BROMOHEPTANOIC ACID ETHYL ESTER 96+%
  • Tianeptine EP Impurity A
  • Ai3-36604
CAS:
29823-18-5
MF:
C9H17BrO2
MW:
237.13
EINECS:
249-883-6
Product Categories:
  • Pharmaceutical Intermediates
  • C8 to C9
  • Carbonyl Compounds
  • Esters
Mol File:
29823-18-5.mol
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Ethyl 7-bromoheptanoate Chemical Properties

Melting point:
29 °C (lit.)
Boiling point:
112 °C/5 mmHg (lit.)
Density 
1.217 g/mL at 25 °C (lit.)
refractive index 
n20/D 1.459(lit.)
Flash point:
>230 °F
storage temp. 
2-8°C
form 
Liquid
color 
Colorless to Almost colorless
InChI
InChI=1S/C9H17BrO2/c1-2-12-9(11)7-5-3-4-6-8-10/h2-8H2,1H3
InChIKey
OOBFNDGMAGSNKA-UHFFFAOYSA-N
SMILES
C(OCC)(=O)CCCCCCBr
CAS DataBase Reference
29823-18-5(CAS DataBase Reference)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-36
WGK Germany 
3
HazardClass 
IRRITANT
HS Code 
2915907098

MSDS

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Ethyl 7-bromoheptanoate Usage And Synthesis

Chemical Properties

Colorless to pale yellow liquid

Uses

Ethyl 7-bromoheptanoate may be used in the following studies:

  • As a starting material in the synthesis of benzyl 7-iodoheptanoate.
  • As one of the reactant in the synthesis of diethyl 7,7′-(2,5-diiodo-1,4-phenylene)bis(oxy)diheptanoate.
  • As one of the reagent in the synthesis of CarnDOD-7C, a carnitine-derived nitrone.
  • As an alkylating agent in the alkylation of ethyl 3-oxoglutarate to form 2-(6-ethoxycarbonylhexyl)-3-oxoglutarate.
  • Synthesis of 1-substituted cyclopentadiene by alkylating lithium cyclopentadienide.5

General Description

Ethyl 7-bromoheptanoate is a bromoester. It is used as an alkylating agent for organic compounds. It participates in the synthesis of ω-chain shortened prostaglandins.

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