2-Pentyl p-toluenesulfonate

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Names

[ CAS No. ]:
3813-69-2

[ Name ]:
2-Pentyl p-toluenesulfonate

[Synonym ]:
toluene-4-sulfonic acid-(1-methyl-butyl ester)
Toluol-4-sulfonsaeure-(1-methyl-butylester)
2-Pentyl tosylate
2-<p-Toluolsulfonyloxy>-pentan
2-amyl tosylate
OSWR D1
2-Pentyl-<4-toluol>-sulfonat
2-pentanol tosylate
2-Pentanol,4-methylbenzenesulfonate
2-Pentanol,p-toluenesulfonate
2-Pentyl p-toluenesulfonate
p-Toluenesulfonic acid,2-pentyl ester
1-Methylbutyl tosylate

Chemical & Physical Properties

[ Density]:
1.1g/cm3

[ Boiling Point ]:
343.9ºC at 760 mmHg

[ Molecular Formula ]:
C12H18O3S

[ Molecular Weight ]:
242.33500

[ Flash Point ]:
161.8ºC

[ Exact Mass ]:
242.09800

[ PSA ]:
51.75000

[ LogP ]:
3.96970

[ Index of Refraction ]:
1.502

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XT7200000
CHEMICAL NAME :
p-Toluenesulfonic acid, 2-pentyl ester
CAS REGISTRY NUMBER :
3813-69-2
BEILSTEIN REFERENCE NO. :
2417601
LAST UPDATED :
199707
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H18-O3-S
MOLECULAR WEIGHT :
242.36
WISWESSER LINE NOTATION :
3Y1&OSWR D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
178 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00674

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Pentanol
  • Tosyl chloride

DownStream

  • Pent-1-ene
  • Pentane, 2-iodo-
  • 2-Pentene, (2E)-
  • CIS-2-PENTENE
  • 2-methylsulfanylpentane
  • 2-methylsulfonylpentane
  • 2-Bromopentane
  • 4-Methyloctane
  • methyl 1-methylbutyl ether

Related Compounds

  • (R)-(-)-2-(P-TOLUENESULFONATE)-1,2-PROPANOL
  • (+)-2-Pentyl-p-toluolsulfonat
  • (S)-(+)-2-(P-TOLUENESULFONATE)-1,2-PROPANEDIOL
  • Benzyl β-L-arabinopyranoside 2-(p-toluenesulfonate)
  • Glucopyranoside,methyl, 3-(p-nitrobenzoate) 2-p-toluenesulfonate, a-D- (8CI)
  • Glucopyranoside,methyl 3,6-anhydro-, 2-p-toluenesulfonate, a-D- (8CI)
  • 3-(3-Bromo-5-nitrophenyl)-2,2-dimethylcyclopropan-1-amine
  • 4-[1-(1-Aminoethyl)cyclopropyl]-2-bromo-6-methoxyphenol
  • 3-Amino-1-(4-methylcyclohexyl)cyclobutane-1-carboxylic acid
  • 2-(1-Isocyanatoethyl)-1-methoxy-4-(trifluoromethyl)benzene
  • 4,4-Difluoro-1-(6-methoxypyridin-3-yl)cyclohexane-1-carboxylic acid
  • 2-(2-Azidoethyl)-3-(methoxymethyl)furan
  • rac-(1R,3R)-3-(2-bromopyridin-3-yl)-2,2-dimethylcyclopropan-1-amine
  • [2,2-Dimethyl-3-(2-methyloxolan-3-yl)cyclopropyl]methanamine
  • tert-butyl N-[2-(1-ethyl-1H-1,2,4-triazol-5-yl)-1-oxopropan-2-yl]carbamate
  • 4-Bromo-3-[(3-methoxyazetidin-3-yl)methyl]phenol
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