288314
1-Bromo-3,4-(methylenedioxy)benzene
97%
Synonym(s):
4-Bromo-1,2-(methylenedioxy)benzene, 5-Bromo-1,3-benzodioxole
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About This Item
Empirical Formula (Hill Notation):
C7H5BrO2
CAS Number:
Molecular Weight:
201.02
Beilstein:
127407
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
97%
form
liquid
refractive index
n20/D 1.583 (lit.)
bp
85-86 °C/1 mmHg (lit.)
density
1.669 g/mL at 25 °C (lit.)
functional group
bromo
SMILES string
Brc1ccc2OCOc2c1
InChI
1S/C7H5BrO2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-3H,4H2
InChI key
FBOYMIDCHINJKC-UHFFFAOYSA-N
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General description
The coupling of 1-bromo-3,4-(methylenedioxy)benzene with β-methallyl alcohol was catalyzed by Pd(OAc)2 in combination with P(t-Bu)3.
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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Arylation of ?-methallyl alcohol catalyzed by Pd (OAc)< sub> 2</sub> in combination with P (< i> t</i>-Bu)< sub> 3</sub>: application to fragrance synthesis.
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