3-Bromotoluene

Suppliers

Names

[ CAS No. ]:
591-17-3

[ Name ]:
3-Bromotoluene

[Synonym ]:
Benzene, 1-bromo-3-methyl-
EINECS 209-702-3
1-Bromo-3-methylbenzene
MFCD00000085
3-Bromotoluene

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
182.1±9.0 °C at 760 mmHg

[ Melting Point ]:
-40 °C

[ Molecular Formula ]:
C7H7Br

[ Molecular Weight ]:
171.035

[ Flash Point ]:
60.0±0.0 °C

[ Exact Mass ]:
169.973099

[ LogP ]:
3.45

[ Vapour Pressure ]:
1.1±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.549

[ Water Solubility ]:
insoluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XS7965400
CHEMICAL NAME :
Toluene, m-bromo-
CAS REGISTRY NUMBER :
591-17-3
BEILSTEIN REFERENCE NO. :
1903633
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C7-H7-Br
MOLECULAR WEIGHT :
171.05
WISWESSER LINE NOTATION :
ER C1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1436 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 44(12),19,1979
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1215 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 44(12),19,1979

Safety Information

[ Symbol ]:

GHS02, GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226-H302-H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R36/37/38

[ Safety Phrases ]:
S26-S36-S37/39

[ RIDADR ]:
UN 1993 3/PG 3

[ WGK Germany ]:
3

[ RTECS ]:
XS7965400

[ Packaging Group ]:
I; II; III

[ Hazard Class ]:
3.0

[ HS Code ]:
29036990

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • m-methylbenzenediazonium tetrafluoroborate
  • 2-Bromo-p-toluidine
  • 3-Bromobenzyl bromide
  • 3-Iodotoluene
  • 3-Toluidine
  • Toluene
  • benzene
  • 1-Bromo-3-iodobenzene
  • methyl iodide
  • 3-Chlorotoluene

DownStream

  • lithium,methylbenzene
  • bis(4-methylphenyl)mercury
  • ETHYL 4-BROMO-2-METHYLBENZOYLFORMATE
  • 3-Bromobenzaldehyde
  • 3,5-Dibromotoluene
  • 3,5-Dibromotoluene
  • 1,2-Dibromo-4-methylbenzene
  • 1-Methyl-3-phenoxybenzene
  • 5-(3-METHYLPHENYL)-5-OXOVALERICACID
  • 3-Bromo-4-chlorotoluene

Customs

[ HS Code ]: 2903999090

[ Summary ]:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

Articles

Efficient cyanation of aryl bromides with K4[Fe(CN)6] catalyzed by a palladium-indolylphosphine complex. Yeung PY, et al.

Tetrahedron Lett. 52(52) , 7038-41, (2011)

High precision determination of bromine isotope ratio by GC-MC-ICPMS. Gelman F and Halicz L.

Int. J. Mass Spectrom. 289(2) , 167-169, (2010)

Heck reaction with an alkenylidenecyclopropane: the formation of arylallylidenecyclopropanes. Fall Y, et al.

Tetrahedron Lett. 48(20) , 3579-81, (2007)


More Articles

Related Compounds

  • 3-Bromotoluene
  • 3-Bromotoluene
  • 2-amino-3-bromotoluene
  • 2-Chloro-3-bromotoluene
  • 2,6-difluoro-3-bromotoluene
  • 4-benzoyloxy-3-bromotoluene
  • {[2-(Difluoromethoxy)phenyl]methyl}(ethyl)amine
  • 2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}aniline
  • 2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]aniline
  • Ethyl (Z)-2-(benzo[d][1,3]dioxol-5-ylmethyl)-3-hydroxyacrylate
  • 5-bromo-3-[(4-nitrophenyl)sulfonyl]-1H-1,2,4-triazole
  • 1-(2-Bromo-3-methylbutanoyl)piperidine-4-carboxamide
  • 2-(Benzyl(methyl)amino)-N-hydroxyacetimidamide
  • 6-Phenoxypyridine-3-carboximidamide
  • 2-{[(6-Chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(4-methoxyphenyl)pyridine-3-carbonitrile
  • 1-(4-Methyl-3-(trifluoromethyl)phenyl)piperazine
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