1,6-Hexanedithiol

Names

[ Name ]:
1,6-Hexanedithiol

[Synonym ]:
1,6-Dimercaptohexane,DMH,Hexamethylene dimercaptan
hexane-1,6-dithiol
1,6-Dimercaptohexane
MFCD00004910
EINECS 214-735-1
1,6-Hexanedithiol

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
242.9±0.0 °C at 760 mmHg

[ Melting Point ]:
−21 °C(lit.)

[ Molecular Formula ]:
C₆H₁₄S₂

[ Molecular Weight ]:
150.305

[ Flash Point ]:
90.6±0.0 °C

[ Exact Mass ]:
150.053696

[ PSA ]:
77.60000

[ LogP ]:
2.80

[ Vapour Pressure ]:
0.1±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.498

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: MO3500000

CHEMICAL NAME :: 1,6-Hexanedithiol

CAS REGISTRY NUMBER :: 1191-43-1

BEILSTEIN REFERENCE NO. :: 1732507

LAST UPDATED :: 199612

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C6-H14-S2

MOLECULAR WEIGHT :: 150.32

WISWESSER LINE NOTATION :: SH6SH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LC - Lethal concentration

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >1490 mg/m3/10M

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NDRC** National Defense Research Committee, Office of Scientific Research and Development, Progress Report. Volume(issue)/page/year: NDCrc-132,Aug,1942

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 100 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Mammal - cat

DOSE/DURATION :: 83 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - muscle weakness Behavioral - ataxia

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 87(Suppl),6,1946

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S23-S24/25

[ RIDADR ]:
2810

[ WGK Germany ]:
3

[ RTECS ]:
MO3500000

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Hexan-1,6-diol
dithiocane
3,10-Dithiadodecane-2,11-dione
1,6-Dibromohexane
1,6-Hexanediyl Bismethanethiosulfonate
Adiponitrile
1,6-diiodohexane
N,N'-dimethyl-N,N'-bis(mercaptoacetyl)hydrazine

DownStream

Hexane,1,6-bis(dimethylthio)-, bromide (1:2)
2-(6-pyridin-2-ylsulfanylhexylsulfanyl)pyridine
Hexane,1,6-bis(2-buten-1-ylthio)-
1,6-bis(methylsulfinyl)hexane
6-phenylsulfanylhexylsulfanylbenzene
dithiocane
1,2,9,10-tetrathiacyclohexadecane
N,N'-dimethyl-N,N'-bis(mercaptoacetyl)hydrazine
3,10-dithia-16-azabicyclo[10.3.1]hexadeca-12,14,16-triene

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Surface modification-induced phase transformation of hexagonal close-packed gold square sheets.

Nat. Commun. 6 , 6571, (2015)

Conventionally, the phase transformation of inorganic nanocrystals is realized under extreme conditions (for example, high temperature or high pressure). Here we report the complete phase transformati...

Optimisation and Characterisation of Anti-Fouling Ternary SAM Layers for Impedance-Based Aptasensors.

Sensors (Basel.) 15 , 25015-32, (2015)

An aptasensor with enhanced anti-fouling properties has been developed. As a case study, the aptasensor was designed with specificity for human thrombin. The sensing platform was developed on screen p...

Surface Eroding, Semicrystalline Polyanhydrides via Thiol-Ene "Click" Photopolymerization.

Biomacromolecules 16 , 1650-9, (2015)

Surface eroding and semicrystalline polyanhydrides, with tunable erosion times and drug delivery pharmacokinetics largely dictated by erosion, are produced easily with thiol-ene "click" polymerization...

1,6-Hexanedithiol diacetate
1,6-Bis(4-morpholinyl-6-methylpyrimidin-2-yl)-1,6-hexanedithiol
2-ethyl fenchol
1,6-diazabicyclo[4.3.2]undecane
1,6-Methano-1H-4-benzazonin-10-ol,2,3,4,5,6,7-hexahydro-4-methyl-,hydrobromide
1-(6-ethylsulfanylhexoxy)-2-propylbenzene
N-(2,4-dimethoxyphenyl)-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
2,5-Dichloro-3,4,6-trifluoropyridine
2-(5-bromo-1H-indol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
N-(furan-2-ylmethyl)-3-phenyl-N-(pyridin-2-yl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
4-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-4-oxo-N-(pyridin-4-ylmethyl)butanamide
{1-[3-(1,1-Difluoro-ethyl)-phenyl]-1H-imidazol-4-yl}-methanol
ethyl 4-{[(5-methoxy-1H-indol-1-yl)acetyl]amino}benzoate
5-[(4-acetylpiperazin-1-yl)carbonyl]-2-cyclopropyl-1H-isoindole-1,3(2H)-dione
N-(4-tert-butylphenyl)-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
N'-(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thiophene-2-carbohydrazide

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