CAS 106-54-7|4-Chlorothiophenol

Introduction：Basic information about CAS 106-54-7|4-Chlorothiophenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Articles6
7. Synonyms

Common Name	4-Chlorothiophenol
CAS Number	106-54-7	Molecular Weight	144.622
Density	1.3±0.1 g/cm3	Boiling Point	206.8±13.0 °C at 760 mmHg
Molecular Formula	C₆H₅ClS	Melting Point	49-51 °C(lit.)
MSDS	ChineseUSA	Flash Point	78.6±19.2 °C
Symbol	GHS05, GHS07	Signal Word	Danger

Names

Name	4-Chlorothiophenol
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.3±0.1 g/cm3
Boiling Point	206.8±13.0 °C at 760 mmHg
Melting Point	49-51 °C(lit.)
Molecular Formula	C₆H₅ClS
Molecular Weight	144.622
Flash Point	78.6±19.2 °C
Exact Mass	143.980042
PSA	38.80000
LogP	3.36
Vapour Pressure	0.3±0.4 mmHg at 25°C
Index of Refraction	1.606
InChIKey	VZXOZSQDJJNBRC-UHFFFAOYSA-N
SMILES	Sc1ccc(Cl)cc1
Water Solubility	insoluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DC1050000

CHEMICAL NAME :: Benzenethiol, p-chloro-

CAS REGISTRY NUMBER :: 106-54-7

BEILSTEIN REFERENCE NO. :: 0605971

LAST UPDATED :: 199709

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C6-H5-Cl-S

MOLECULAR WEIGHT :: 144.62

WISWESSER LINE NOTATION :: SHR DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,989,1986

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 :: 75 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: AD691-490 ** TUMORIGENIC DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 8000 mg/kg/20W-I

TOXIC EFFECTS :: Tumorigenic - equivocal tumorigenic agent by RTECS criteria Skin and Appendages - tumors

REFERENCE :: CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 19,413,1959

Safety Information

Symbol	GHS05, GHS07
Signal Word	Danger
Hazard Statements	H302-H314
Precautionary Statements	P280-P305 + P351 + P338-P310
Personal Protective Equipment	Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard Codes	C:Corrosive;
Risk Phrases	R22;R34
Safety Phrases	S26-S36/37/39-S45
RIDADR	UN 3261 8/PG 2
WGK Germany	3
RTECS	DC1050000
Packaging Group	III
Hazard Class	8
HS Code	2934999090

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%

Articles6

Growth of Thin, Anisotropic, π-Conjugated Molecular Films by Stepwise "Click" Assembly of Molecular Building Blocks: Characterizing Reaction Yield, Surface Coverage, and Film Thickness versus Addition Step Number.

J. Am. Chem. Soc. 137 , 8819-28, (2015)

We report the systematic characterization of anisotropic, π-conjugated oligophenyleneimine (OPI) films synthesized using stepwise imine condensation, or "click" chemistry. Film synthesis began with a ...

Concave Rhombic Dodecahedral Au Nanocatalyst with Multiple High-Index Facets for CO2 Reduction.

ACS Nano 9 , 8384-93, (2015)

A concave rhombic dodecahedron (RD) gold nanoparticle was synthesized by adding 4-aminothiophenol (4-ATP) during growth from seeds. This shape is enclosed by stabilized facets of various high-indexes,...

Synthesis and antibacterial activity of some novel 4-oxopyrido[2,3-a]phenothiazines.

Arch. Pharm. (Weinheim) 347(11) , 861-72, (2014)

A series of substituted 4-oxopyrido[2,3-a]phenothiazine-3-carboxylic acids (6a-d) were prepared via cyclization of the corresponding ethyl 7-(arylthioxy)-8-nitro(or azido)-4-oxoquinoline-3-carboxylate...

Synonyms

Benzenethiol, 4-chloro-

4-Chloromercaptobenzene

EINECS 203-408-9

MFCD00004847

4-Chlorobenzenethiol

4-Chlorothiophenol

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