6-nitro-1,3-benzothiazole-2-thiol

Modify Date: 2024-01-02 10:27:33

6-nitro-1,3-benzothiazole-2-thiol structure	Common Name	6-nitro-1,3-benzothiazole-2-thiol
	CAS Number	4845-58-3	Molecular Weight	212.249
	Density	1.6±0.1 g/cm3	Boiling Point	380.8±34.0 °C at 760 mmHg
	Molecular Formula	C₇H₄N₂O₂S₂	Melting Point	249-253 °C
	MSDS	N/A	Flash Point	184.1±25.7 °C

Name	2-Mercapto-6-Nitrobenzothiazole
Synonym	More Synonyms

Density	1.6±0.1 g/cm3
Boiling Point	380.8±34.0 °C at 760 mmHg
Melting Point	249-253 °C
Molecular Formula	C₇H₄N₂O₂S₂
Molecular Weight	212.249
Flash Point	184.1±25.7 °C
Exact Mass	211.971420
PSA	125.75000
LogP	2.14
Vapour Pressure	0.0±0.8 mmHg at 25°C
Index of Refraction	1.789

6-nitro-1,3-benzothiazole-2-thiol MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DL6600000

CHEMICAL NAME :: 2-Benzothiazolethiol, 6-nitro-

CAS REGISTRY NUMBER :: 4845-58-3

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C7-H4-N2-O2-S2

MOLECULAR WEIGHT :: 212.25

WISWESSER LINE NOTATION :: T56 BN DSJ CSH GNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 25 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

Hazard Codes	T: Toxic;
Risk Phrases	R36/37/38
Safety Phrases	S45-S36/37/39-S26
RTECS	DL6600000
HS Code	2934999090

2-Mercaptobenzo...

CAS#:149-30-4

~0%

2,2'-Dithiobis(...

CAS#:120-78-5

6-nitro-1,3-ben...

CAS#:4845-58-3

Literature: University of Iowa Research Foundation Patent: US4975448 A1, 1990 ;

2-Bromo-4-nitro...

CAS#:13296-94-1

potassium ethyl...

CAS#:140-89-6

~94%

6-nitro-1,3-ben...

CAS#:4845-58-3

Literature: Huang, Wei; Tan, Ying; Ding, Ming-Wu; Yang, Guang-Fu Synthetic Communications, 2007 , vol. 37, # 3 p. 369 - 376

2-Mercaptobenzo...

CAS#:149-30-4

~54%

6-nitro-1,3-ben...

CAS#:4845-58-3

Literature: Kouge, Katsushige; Koizumi, Tatsuya; Ishibashi, Norio; Okai, Hideo Agricultural and Biological Chemistry, 1987 , vol. 51, # 7 p. 1941 - 1946

Ethanol

CAS#:64-17-5

2-chloro-6-nitr...

CAS#:2407-11-6

1,3-Dicyclohexy...

CAS#:1212-29-9

1,3-Dicyclohexylurea

CAS#:2387-23-7

Detail

Literature: Scott; Watt Journal of Organic Chemistry, 1937 , vol. 2, p. 148,153

Precursor 6
CAS#:149-30-4 2-Mercaptobenzo... CAS#:13296-94-1 2-Bromo-4-nitro... CAS#:140-89-6 potassium ethyl... CAS#:64-17-5 Ethanol
CAS#:2407-11-6 2-chloro-6-nitr... CAS#:1212-29-9 1,3-Dicyclohexy...
DownStream 10
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