N-tert-Butyl-2-benzothiazolesulfenaMide

Modify Date: 2024-01-02 15:55:04

N-tert-Butyl-2-benzothiazolesulfenaMide Structure
N-tert-Butyl-2-benzothiazolesulfenaMide structure
Common Name N-tert-Butyl-2-benzothiazolesulfenaMide
CAS Number 95-31-8 Molecular Weight 238.372
Density 1.2±0.1 g/cm3 Boiling Point 344.1±25.0 °C at 760 mmHg
Molecular Formula C11H14N2S2 Melting Point 105°C
MSDS N/A Flash Point 161.9±23.2 °C

 Names

Name Accelerator BBTS
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 344.1±25.0 °C at 760 mmHg
Melting Point 105°C
Molecular Formula C11H14N2S2
Molecular Weight 238.372
Flash Point 161.9±23.2 °C
Exact Mass 238.059845
PSA 78.46000
LogP 4.49
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.642

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DL6200000
CHEMICAL NAME :
2-Benzothiazolesulfenamide, N-tert-butyl-
CAS REGISTRY NUMBER :
95-31-8
BEILSTEIN REFERENCE NO. :
0158370
LAST UPDATED :
199710
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C11-H14-N2-S2
MOLECULAR WEIGHT :
238.39
WISWESSER LINE NOTATION :
T56 BN DSJ CSMX1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7940 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - food intake (animal) Behavioral - muscle weakness
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>7940 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Morphological transformation
TEST SYSTEM :
Rodent - mouse Embryo
DOSE/DURATION :
35 mg/L
REFERENCE :
ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 5,193,1983 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 82857 No. of Facilities: 835 (estimated) No. of Industries: 5 No. of Occupations: 17 No. of Employees: 20056 (estimated) No. of Female Employees: 2039 (estimated)

 Safety Information

Hazard Codes Xi
Risk Phrases R43;R53
Safety Phrases S36-S45-S61
RIDADR 3077
RTECS DL6200000
Packaging Group III
Hazard Class 9

 Synthetic Route

~79%

N-tert-Butyl-2-benzothiazolesulfenaMide Structure

N-tert-Butyl-2-...

CAS#:95-31-8

Literature: Monsanto Europe S.A. Patent: US4461897 A1, 1984 ;

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N-tert-Butyl-2-benzothiazolesulfenaMide Structure

N-tert-Butyl-2-...

CAS#:95-31-8

Literature: Journal of Organic Chemistry, , vol. 43, p. 3223 - 3227

~%

N-tert-Butyl-2-benzothiazolesulfenaMide Structure

N-tert-Butyl-2-...

CAS#:95-31-8

Literature: Journal of the American Chemical Society, , vol. 79, p. 5270,5271

 Synonyms

EINECS 202-409-1
N-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine
2-Benzothiazolesulfenamide, N- (1,1-dimethylethyl)-
N-(1,3-benzothiazol-2-ylthio)-2-methylpropan-2-amine
2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)-
N-(1,3-Benzothiazol-2-ylsulfanyl)-2-methyl-2-propanamine
S-Benzothiazol-2-yl-N-tert-butyl-thiohydroxylamine
MFCD00022873
N-tert-Butyl-2-benzothiazolesulfenaMide
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