β-Chloroethyl p-toluenesulfonate

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Names

[ CAS No. ]:
80-41-1

[ Name ]:
β-Chloroethyl p-toluenesulfonate

[Synonym ]:
p-Toluenesulfonic acid, β-chloroethyl ester
Ethanol, 2-chloro-, 4-methylbenzenesulfonate
2-Chloroethyl 4-methylbenzenesulfonate
MFCD00000970
β-Chloroethyl p-toluenesulfonate
EINECS 201-277-2
Ethanol, 2-chloro-, p-toluenesulfonate (8CI)

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
393.3±0.0 °C at 760 mmHg

[ Melting Point ]:
157-161ºC

[ Molecular Formula ]:
C9H11ClO3S

[ Molecular Weight ]:
234.700

[ Flash Point ]:
185.5±20.9 °C

[ Exact Mass ]:
234.011749

[ PSA ]:
51.75000

[ LogP ]:
1.90

[ Vapour Pressure ]:
0.0±0.8 mmHg at 25°C

[ Index of Refraction ]:
1.529

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XT6475000
CHEMICAL NAME :
p-Toluenesulfonic acid, beta-chloroethyl ester
CAS REGISTRY NUMBER :
80-41-1
BEILSTEIN REFERENCE NO. :
1968816
LAST UPDATED :
199707
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H11-Cl-O3-S
MOLECULAR WEIGHT :
234.71
WISWESSER LINE NOTATION :
G2OSWR D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1068,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
498 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1068,1986

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302

[ 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

[ Safety Phrases ]:
S23-S36/37/39

[ RIDADR ]:
2810

[ WGK Germany ]:
3

[ RTECS ]:
XT6475000

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Tosyl chloride
  • 2-Chloroethanol
  • ethene
  • 1-Bromo-2-chloroethane
  • Methyl p-toluenesulfonate
  • Tetrabutylammonium 4-toluenesulfonate
  • ETHYLENE OXIDE
  • 2-chloroethyl chlorosulfonate
  • Toluene

DownStream

  • 5-(2-chloroethoxy)-2,3-dihydroinden-1-one
  • 1-bromo-4-(2-chloroethoxy)benzene
  • 4-(2-Chloroethoxy)benzaldehyde
  • 2-Chloroethyl Benzoate
  • 1-(2-CHLORO-ETHOXY)-2-METHYL-BENZENE
  • 10-(2-chloroethyl)-3-methoxy-phenothiazine
  • 12-(2-chloroethyl)-10-methylbenzo[a]phenothiazine
  • 12-(2-chloroethyl)benzo[b]phenothiazine
  • 2-(2-chloroethylsulfanylmethyl)furan
  • 1-(2-chloroethylsulfanyl)-4-methyl-benzene

Articles

Separation of aromatic hydrophobic sulfonates by micellar electrokinetic chromatography.

J. Chromatogr. A. 1161(1) , 322-326, (2007)

Two different buffer systems for the separation of 12 aromatic hydrophobic sulfonates by micellar electrokinetic chromatography (MEKC) were developed. The following buffer systems were used: aqueous p...


More Articles

Related Compounds

  • N,N-BIS(2-CHLOROETHYL)-P-TOLUENESULFONAMIDE
  • β-chloroethyl-butylketone
  • β-chloroethyl radical
  • (β-chloroethyl-2 dimethoxy-4,5 benzyl) methylphosphinate d'ethyle
  • β-(p-Tolyl)-hydrozimtsaeurenitril
  • β-(p-Phenylazophenoxy)-N,N-bis[2-(p-phenylazophenoxy)ethyl]ethanamine
  • 3-(2-bromophenyl)-N-(2,3-dimethylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine
  • 7-Hydroxy-4-methyl-6-(4-nitro-phenylazo)-chromen-2-one
  • 6-(3,4-Dimethoxyphenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
  • 2-[4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazin-1-yl]-N-(4-phenoxyphenyl)acetamide
  • 4-(2-{[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino}ethyl)-N-phenylpiperazine-1-carboxamide
  • 2-({[2-(4-Hexanoylpiperazin-1-yl)ethyl]amino}methylidene)-5-(4-methoxyphenyl)cyclohexane-1,3-dione
  • (E)-N'-(9-((2R,3R,4R,5R)-4-Hydroxy-5-(hydroxymethyl)-3-methoxytetrahydrofuran-2-yl)-6-oxo-6,9-dihydro-1H-purin-2-yl)-N,N-dimethylformimidamide
  • 1,3-Benzodioxol-4(5h)-one,6-(2,3-dihydro-1h-indol-7-yl)-5-(4,4-dimethyl-2-oxazolidinylidene)-,(5e)-
  • 2-Methyl-5-nitro-4-[2,3,5,6-tetrafluoro-4-(1H-imidazol-1-yl)phenyl]-1H-imidazole
  • 3-((3-chlorobenzyl)thio)-6-methyl-1,2,4-triazin-5(4H)-one
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