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About This Item
Linear Formula:
Br(CH2)3C(OCH3)3
CAS Number:
Molecular Weight:
227.10
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Assay
95%
form
liquid
refractive index
n20/D 1.456 (lit.)
bp
70 °C/0.7 mmHg (lit.)
density
1.309 g/mL at 25 °C (lit.)
functional group
bromo
ether
storage temp.
2-8°C
SMILES string
COC(CCCBr)(OC)OC
InChI
1S/C7H15BrO3/c1-9-7(10-2,11-3)5-4-6-8/h4-6H2,1-3H3
InChI key
QBLJMYITBNHQOT-UHFFFAOYSA-N
Application
Trimethyl 4-bromoorthobutyrate was used in the synthesis of macrocyclic lactone (S)-curvularin. Grignard reagent derived from trimethyl 4-bromoorthobutyrate was used in the preparation of novel hapten 4-(17 β-hydroxy-3-oxoestra-4,9-dien-11-β-yl)butanoic acid, used in enzyme-linked immunosorbent assay (ELISA) for testosterone.
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)
163.4 °F - closed cup
Flash Point(C)
73 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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