CAS 4665-63-8|2-(2-Benzothiazolylthio)ethanol

Introduction：Basic information about CAS 4665-63-8|2-(2-Benzothiazolylthio)ethanol, 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. Articles4
7. Synonyms

Common Name	2-(2-Benzothiazolylthio)ethanol
CAS Number	4665-63-8	Molecular Weight	211.30400
Density	1.39g/cm3	Boiling Point	378.4ºC at 760mmHg
Molecular Formula	C₉H₉NOS₂	Melting Point	50-55ºC(lit.)
MSDS	ChineseUSA	Flash Point	182.7ºC
Symbol	GHS07	Signal Word	Warning

Names

Name	2-(1,3-benzothiazol-2-ylsulfanyl)ethanol
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.39g/cm3
Boiling Point	378.4ºC at 760mmHg
Melting Point	50-55ºC(lit.)
Molecular Formula	C₉H₉NOS₂
Molecular Weight	211.30400
Flash Point	182.7ºC
Exact Mass	211.01300
PSA	86.66000
LogP	2.38070
Index of Refraction	1.707
InChIKey	PYNOHHMFQYUSDD-UHFFFAOYSA-N
SMILES	OCCSc1nc2ccccc2s1

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DL4900000

CHEMICAL NAME :: Benzothiazole, 2-(2-hydroxyethylthio)-

CAS REGISTRY NUMBER :: 4665-63-8

LAST UPDATED :: 199309

WISWESSER LINE NOTATION :: T56 BN DSJ CS2Q

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1017 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Vascular - regional or general arteriolar or venous dilation Gastrointestinal - changes in structure or function of salivary glands

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,221,1969

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 417 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Vascular - regional or general arteriolar or venous dilation Gastrointestinal - changes in structure or function of salivary glands

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,221,1969 ** OTHER MULTIPLE DOSE TOXICITY DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 728 mg/kg/7D-I

TOXIC EFFECTS :: Liver - liver function tests impaired

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,221,1969

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302-H312-H315-H319-H332-H335
Precautionary Statements	P261-P280-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xn: Harmful;
Risk Phrases	20/21/22-36/37/38
Safety Phrases	26-36
RIDADR	NONH for all modes of transport
RTECS	DL4900000
HS Code	2934999090

Customs

HS Code	2934999090
Summary	2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles4

Spectral features, electric properties, NBO analysis and reactivity descriptors of 2-(2-Benzothiazolylthio)-Ethanol: Combined experimental and DFT studies.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 136PC , 1205-1215, (2014)

Quantum chemical calculations of ground state energy, geometrical structure and vibrational wavenumbers, nuclear magnetic behaviors, electronic absorption spectra along with the nonlinear optical prop...

Identification of novel micropollutants in wastewater by a combination of suspect and nontarget screening.

Environ. Pollut. 184 , 25-32, (2014)

To detect site-specific, suspected and formerly unknown contaminants in a wastewater treatment plant effluent, we established a screening procedure based on liquid chromatography-high resolution mass ...

Leaching of a contaminant into the contents of disposable syringes.

Aust. N. Z. J. Med. 11(2) , 208-9, (1981)

Synonyms

2-benzothiazol-2-ylmercapto-ethanol

MFCD00463760

2-(Benzothiazol-2-ylsulfanyl)-ethanol

HMBT

2-Benzothiazol-2-ylmercapto-aethanol

2-(2-benzothiazolylthio)ethanol

2-<2-Hydroxy-ethyl >-mercapto-benzthiazol

2,6-PYRIDINE DICARBOXYLIC ACID METHYL ESTER,>

2-benzothiazol-2-ylthioethan-1-ol

2-(2-Hydroxyethylmercapto)benzothiazole

BENZOTHIAZOLE,2-(2-HYDROXYETHYLTHIO)

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