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115117-88-9

115117-88-9 | Benzene, [(1Z)-3-bromo-1-propen-1-yl]-

CAS No: 115117-88-9 Catalog No: AG000GBO MDL No:

Product Description

Catalog Number:
AG000GBO
Chemical Name:
Benzene, [(1Z)-3-bromo-1-propen-1-yl]-
CAS Number:
115117-88-9
Molecular Formula:
C9H9Br
Molecular Weight:
197.0718
IUPAC Name:
3-bromoprop-1-enylbenzene
InChI:
InChI=1S/C9H9Br/c10-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2
InChI Key:
RUROFEVDCUGKHD-UHFFFAOYSA-N
SMILES:
BrC/C=C\c1ccccc1

Properties

Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.989g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.075g/mol
Monoisotopic Mass:
195.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.4  

Literature

Title Journal
Double C-H functionalization in sequential order: direct synthesis of polycyclic compounds by a palladium-catalyzed C-H alkenylation-arylation cascade. Chemistry (Weinheim an der Bergstrasse, Germany) 20120423
Complete sets of monosubstituted cyclomaltohexaoses (α-cyclodextrins) as precursors for further synthesis. Carbohydrate research 20111108
Indium-mediated asymmetric barbier-type allylations: additions to aldehydes and ketones and mechanistic investigation of the organoindium reagents. The Journal of organic chemistry 20100205
Silver-catalyzed one-pot synthesis of arylnaphthalene lactones. The Journal of organic chemistry 20080905
Nematicidal Activity of Cassia and Cinnamon Oil Compounds and Related Compounds toward Bursaphelenchus xylophilus (Nematoda: Parasitaphelenchidae). Journal of nematology 20070301
Simple preparation of 3I-O-substituted beta-cyclodextrin derivatives using cinnamyl bromide. The Journal of organic chemistry 20051028

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