11-propan-2-ylsulfanylundecanoic acid

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Names

[ Name ]:
11-propan-2-ylsulfanylundecanoic acid

[Synonym ]:
Undecanoic acid,11-[(1-methylethyl)thio]
Undecanoic acid,11-isopropylthio
11-Isopropylthioundecanoic acid
Hendecanoic acid,11-isopropylthio

Chemical & Physical Properties

[ Density]:
0.969g/cm3

[ Boiling Point ]:
383.4ºC at 760 mmHg

[ Molecular Formula ]:
C₁₄H₂₈O₂S

[ Molecular Weight ]:
260.43600

[ Flash Point ]:
185.7ºC

[ Exact Mass ]:
260.18100

[ PSA ]:
62.60000

[ LogP ]:
4.72350

[ Vapour Pressure ]:
6.08E-07mmHg at 25°C

[ Index of Refraction ]:
1.48

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: YQ2570000

CHEMICAL NAME :: Undecanoic acid, 11-isopropylthio-

CAS REGISTRY NUMBER :: 102613-00-3

LAST UPDATED :: 198609

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H28-O2-S

MOLECULAR WEIGHT :: 260.48

WISWESSER LINE NOTATION :: QV10SY1&1

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 :: 56 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#08152

Related Compounds

11-naphthalen-2-ylsulfanylundecanoic acid
11-propan-2-yl-5H-dipyrido[2,3-b:2',3'-f][1,4]diazepin-6-one
11-propan-2-ylidenebicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
11-propan-2-yloxy-15,16-dihydrocyclopenta[a]phenanthren-17-one
(Z)-but-2-enedioic acid,11-propan-2-yl-10,12-dihydro-5H-benzo[d][2]benzazocine
6-methyl-11-propan-2-yloxy-11H-benzo[c][1,2]benzothiazepine 5,5-dioxide
4-(1-(Pyrazin-2-yl)ethyl)piperazine-2-carboxylic acid
N-(1-(1-cyclopropyl-1H-imidazol-2-yl)ethyl)cyclopropanamine
tert-Butyl 3-((1-(1H-pyrrol-2-yl)ethyl)amino)pyrrolidine-1-carboxylate
tert-Butyl 3-((1-(furan-2-yl)ethyl)amino)pyrrolidine-1-carboxylate
tert-Butyl 4-((1-(pyrazin-2-yl)ethyl)amino)piperidine-1-carboxylate
tert-Butyl 2-(((1-(1H-pyrrol-2-yl)ethyl)amino)methyl)piperidine-1-carboxylate
tert-Butyl 3-(((1-(thiophen-2-yl)ethyl)amino)methyl)piperidine-1-carboxylate
tert-Butyl 3-(((1-(pyridin-2-yl)ethyl)amino)methyl)piperidine-1-carboxylate
tert-Butyl 2-(((1-(furan-2-yl)ethyl)amino)methyl)pyrrolidine-1-carboxylate
4-((1-(furan-3-carbonyl)azetidin-3-yl)oxy)-6-methyl-2H-pyran-2-one

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