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2-Bromotoluene

CAS No.:
95-46-5
Catalog Number:
AG003371
Molecular Formula:
C7H7Br
Molecular Weight:
171.0345
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$62
- +
500g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG003371
Chemical Name:
2-Bromotoluene
CAS Number:
95-46-5
Molecular Formula:
C7H7Br
Molecular Weight:
171.0345
MDL Number:
MFCD00000068
IUPAC Name:
1-bromo-2-methylbenzene
InChI:
InChI=1S/C7H7Br/c1-6-4-2-3-5-7(6)8/h2-5H,1H3
InChI Key:
QSSXJPIWXQTSIX-UHFFFAOYSA-N
SMILES:
Cc1ccccc1Br
EC Number:
202-421-7
UNII:
TBG2F2VA19
NSC Number:
6532
UN Number:
1760
Properties
Complexity:
70.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.973g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.037g/mol
Monoisotopic Mass:
169.973g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Literature
Title Journal
Phosphino imidazoles and imidazolium salts for Suzuki C-C coupling reactions. Dalton transactions (Cambridge, England : 2003) 20120507
Replacing conventional carbon nucleophiles with electrophiles: nickel-catalyzed reductive alkylation of aryl bromides and chlorides. Journal of the American Chemical Society 20120411
Methyl 2-(2-bromo-benzyl-idene)-5-(4-hy-droxy-phen-yl)-7-methyl-3-oxo-2,3-dihydro-5H-1,3-thia-zolo[3,2-a]pyrimidine-6-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20120401
Degradation of 2-chlorotoluene by Rhodococcus sp. OCT 10. Applied microbiology and biotechnology 20120301
Triarylmethanes, a new class of cx50 inhibitors. Frontiers in pharmacology 20120101
Synthesis of 2-naphthols via carbonylative Stille coupling reaction of 2-bromobenzyl bromides with tributylallylstannane followed by the Heck reaction. The Journal of organic chemistry 20111216
Dual modulation of GIP and glucagon action by the low molecular weight compound 4-hydroxybenzoic acid 2-bromobenzylidene hydrazide. Diabetes, obesity & metabolism 20110801
Vibrational spectroscopic analysis of 2-chlorotoluene and 2-bromotoluene: a combined experimental and theoretical study. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20101201
Structure-activity relationship of dopaminergic halogenated 1-benzyl-tetrahydroisoquinoline derivatives. European journal of medicinal chemistry 20091101
Similarities and differences between bis[2-(bromomethyl)phenyl] diselenide, bis[2-(chloromethyl)phenyl] diselenide and bis[2-(hydroxymethyl)phenyl] diselenide. Acta crystallographica. Section C, Crystal structure communications 20090801
Biaryl formation from 5-(2-bromobenzyl)-substituted piperidin-2-ones via palladacycles. Organic letters 20080619
Radical reactions with 2-bromobenzylidene group, a protecting/radical-translocating group for the 1,6-radical hydrogen transfer reaction. Organic letters 20060720
Organic intercalation material: reversible change in interlayer distances by guest release and insertion in sandwich-type inclusion crystals of cholic acid. Chemistry (Weinheim an der Bergstrasse, Germany) 20050304
Properties