Pentachlorothiophenol

Modify Date: 2024-01-02 15:56:51

Pentachlorothiophenol Structure
Pentachlorothiophenol structure
 Common Name Pentachlorothiophenol
CAS Number 133-49-3 Molecular Weight 282.402
Density 1.7±0.1 g/cm3 Boiling Point 351.3±37.0 °C at 760 mmHg
Molecular Formula C6HCl5S Melting Point 223-227 °C(lit.)
MSDS Chinese USA Flash Point 144.6±25.9 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name Pentachlorothiophenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.7±0.1 g/cm3
Boiling Point 351.3±37.0 °C at 760 mmHg
Melting Point 223-227 °C(lit.)
Molecular Formula C6HCl5S
Molecular Weight 282.402
Flash Point 144.6±25.9 °C
Exact Mass 279.824158
PSA 38.80000
LogP 5.43
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.648

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DC1925000
CHEMICAL NAME :
Benzenethiol, pentachloro-
CAS REGISTRY NUMBER :
133-49-3
BEILSTEIN REFERENCE NO. :
1108638
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C6-H-Cl5-S
MOLECULAR WEIGHT :
282.38
WISWESSER LINE NOTATION :
SHR BG CG DG EG FG

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: -,989,1986 ** ACUTE TOXICITY DATA **
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 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 81922 No. of Facilities: 61 (estimated) No. of Industries: 3 No. of Occupations: 9 No. of Employees: 769 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 81922 No. of Facilities: 1259 (estimated) No. of Industries: 6 No. of Occupations: 12 No. of Employees: 24076 (estimated) No. of Female Employees: 2595 (estimated)

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H319
Precautionary Statements P305 + P351 + P338
Hazard Codes Xi
Risk Phrases R20/22
RIDADR UN 3335
WGK Germany 3
RTECS DC1925000
HS Code 2930909090

 Synthetic Route

Hexachlorobenzene structure

Hexachlorobenzene

CAS#:118-74-1

~19%

Pentachlorothiophenol Structure

Pentachlorothio...

CAS#:133-49-3

Literature: Synthetic Communications, , vol. 22, # 22 p. 3277 - 3284
Pentachloronitrobenzene structure

Pentachloronitr...

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~55%

Pentachlorothiophenol Structure

Pentachlorothio...

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Literature: Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, , vol. 20, # 12 p. 1086 - 1087
(Z,Z)-2,3,4,5-Tetrachlor-2,4-pentadienthiosaeure-S-pentachlorphenylester structure

(Z,Z)-2,3,4,5-T...

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~24%

Pentachlorothiophenol Structure

Pentachlorothio...

CAS#:133-49-3

3,4,5-trichloropyran-2-one structure

3,4,5-trichloro...

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Literature: Liebigs Annalen der Chemie, , # 12 p. 1960 - 1971
sodium pentachlorobenzenethiolate structure

sodium pentachl...

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~%

Pentachlorothiophenol Structure

Pentachlorothio...

CAS#:133-49-3

Literature: Liebigs Annalen der Chemie, , # 12 p. 1960 - 1971
1,2,3,4,5-pentachloro-6-chlorosulfanyl-benzene structure

1,2,3,4,5-penta...

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Isobutane Residual Solvent Standard structure

Isobutane Resid...

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~%

Pentachlorothiophenol Structure

Pentachlorothio...

CAS#:133-49-3

Bis(pentachlorophenyl) disulfide structure

Bis(pentachloro...

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Detail
Literature: Canadian Journal of Chemistry, , vol. 51, p. 1870 - 1879
Pentachloroaniline structure

Pentachloroaniline

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~%

Pentachlorothiophenol Structure

Pentachlorothio...

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Literature: Journal of the Chemical Society, , p. 1155
Benzene,1,2,3,4,5-pentachloro-6-fluoro- structure

Benzene,1,2,3,4...

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~%

Pentachlorothiophenol Structure

Pentachlorothio...

CAS#:133-49-3

Literature: J. Gen. Chem. USSR (Engl. Transl.), , vol. 35, # 11 p. 2055 - 2062,2046 - 2052
1,2,3,4,5-pentachloro-6-chlorosulfanyl-benzene structure

1,2,3,4,5-penta...

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cyclohexane structure

cyclohexane

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~%

Pentachlorothiophenol Structure

Pentachlorothio...

CAS#:133-49-3

Chlorocyclohexane structure

Chlorocyclohexane

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Detail
Literature: Canadian Journal of Chemistry, , vol. 51, p. 1870 - 1879

 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%

 Articles7

More Articles
Sex-related difference in hepatic glutathione conjugation of hexachlorobenzene in the rat.

Toxicol. Appl. Pharmacol. 112(2) , 229-34, (1992)

Hexachlorobenzene (HCB) induces hepatic porphyria and liver cancer in female rats, whereas toxicity is minimal in male rats. HCB is biotransformed to sulfur-containing metabolites originating from con...

Effect of estradiol on the induction of porphyria by hexachlorobenzene in the rat.

Biochem. Pharmacol. 54(1) , 19-25, (1997)

Hexachlorobenzene (HCB) is porphyrinogenic in adult female but not in male rats. This study aimed to assess the role of 17beta-estradiol in the induction of porphyria by HCB in both sexes by adding or...

Conversion products of hexachlorobenzene and their role in the disturbance of the porphyrin pathway in rats.

Int. J. Biochem. 12(5-6) , 1003-6, (1980)

 Synonyms

Pentachlorothiophenol
2,3,4,5,6-pentachlorobenzenethiol
Benzenethiol, 2,3,4,5,6-pentachloro-
EINECS 205-107-8
Pentachlorobenzenethiol
MFCD00059146
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