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98-81-7

98-81-7 | (1-Bromovinyl)benzene

CAS No: 98-81-7 Catalog No: AG003A7D MDL No:MFCD00012229

Product Description

Catalog Number:
AG003A7D
Chemical Name:
(1-Bromovinyl)benzene
CAS Number:
98-81-7
Molecular Formula:
C8H7Br
Molecular Weight:
183.0452
MDL Number:
MFCD00012229
IUPAC Name:
1-bromoethenylbenzene
InChI:
InChI=1S/C8H7Br/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H2
InChI Key:
SRXJYTZCORKVNA-UHFFFAOYSA-N
SMILES:
BrC(=C)c1ccccc1
EC Number:
202-702-4
UNII:
LF0SJ1821N

Properties

Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.973g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.048g/mol
Monoisotopic Mass:
181.973g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Literature

Title Journal
In situ generation of vinyl allenes and its applications to one-pot assembly of cyclohexene, cyclooctadiene, 3,7-nonadienone, and bicyclo[6.4.0]dodecene derivatives with palladium-catalyzed multicomponent reactions. Journal of the American Chemical Society 20060201
Cascade alkenyl amination/Heck reaction promoted by a bifunctional palladium catalyst: a novel one-pot synthesis of indoles from o-haloanilines and alkenyl halides. Chemistry (Weinheim an der Bergstrasse, Germany) 20050408

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