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About This Item
Linear Formula:
Br(CH2)6CO2C2H5
CAS Number:
Molecular Weight:
237.13
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
97%
refractive index
n20/D 1.459 (lit.)
bp
112 °C/5 mmHg (lit.)
mp
29 °C (lit.)
density
1.217 g/mL at 25 °C (lit.)
functional group
bromo
ester
SMILES string
CCOC(=O)CCCCCCBr
InChI
1S/C9H17BrO2/c1-2-12-9(11)7-5-3-4-6-8-10/h2-8H2,1H3
InChI key
OOBFNDGMAGSNKA-UHFFFAOYSA-N
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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.
Application
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
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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