[4-(4-thiocyanatoanilino)phenyl] thiocyanate

Names

[ Name ]:
[4-(4-thiocyanatoanilino)phenyl] thiocyanate

[Synonym ]:
iminodibenzene-4,1-diyl bis(thiocyanate)
p,p-Dithiocyanatodiphenylamine
4,4'-Di(thiocyano)diphenylamine
Diphenylamine,4,4'-dithiocyano
Thiocyanic acid,diester with p,p'-iminodiphenol
TL 377
4.4'-Dirhodan-diphenylamin
(4,4'-dithiocyanato)diphenylamine
Thiocyanic acid,iminodi-4,1-phenylene ester
Bis-(4-thiocyanato-phenyl)-amin
bis-(4-thiocyanato-phenyl)-amine

Chemical & Physical Properties

[ Density]:
1.37g/cm3

[ Boiling Point ]:
481.5ºC at 760 mmHg

[ Molecular Formula ]:
C₁₄H₉N₃S₂

[ Molecular Weight ]:
283.37100

[ Flash Point ]:
245ºC

[ Exact Mass ]:
283.02400

[ PSA ]:
110.21000

[ LogP ]:
4.64956

[ Index of Refraction ]:
1.709

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XK9205000

CHEMICAL NAME :: Thiocyanic acid, diester with p,p'-iminodiphenol

CAS REGISTRY NUMBER :: 5339-39-9

BEILSTEIN REFERENCE NO. :: 3361936

LAST UPDATED :: 199612

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C14-H9-N3-S2

MOLECULAR WEIGHT :: 283.38

WISWESSER LINE NOTATION :: NCSR DMR DSCN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LCLo - Lowest published lethal concentration

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 400 mg/m3/10M

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NDRC** National Defense Research Committee, Office of Scientific Research and Development, Progress Report. Volume(issue)/page/year: NDCrc-132,SEP1942

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 5,289,1953

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03897

Safety Information

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Diphenylamine
Lead (II) thiocyanate

DownStream

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%

Related Compounds

[4-[(4-nitrobenzoyl)amino]phenyl] thiocyanate
[3,5-dimethyl-4-[(4-nitrobenzoyl)amino]phenyl] thiocyanate
1,3-bis(4-thiocyanatophenyl)thiourea
4-Methylpentanoic acid isoamyl ester
[4-[(3,4-dichlorophenyl)carbamoylamino]phenyl] thiocyanate
4-Thiocyanato-2-(trifluoromethoxy)aniline
tert-butyl N-{1-[1-(aminomethyl)-3,3-difluorocyclobutyl]-2,2-dimethylpropyl}carbamate
tert-butyl N-[1-(1-cyano-3-oxocyclobutyl)-2,2-dimethylpropyl]carbamate
5-Acetamido-3-(propan-2-yl)thiophene-2-carboxylic acid
1-Acetyl-2,2,6,6-tetramethylpiperidine-4-carboxylic acid
1-Acetyl-6-methyl-2-(propan-2-yl)piperidine-3-carboxylic acid
tert-butyl N-[1-(4-amino-1,2-oxazol-5-yl)-2,2-dimethylpropyl]carbamate
tert-butyl N-[2-(3,5-dimethylphenyl)-1-oxopropan-2-yl]carbamate
2-(2-{[(Tert-butoxy)carbonyl]amino}-5-hydroxyphenyl)prop-2-enoic acid
rac-tert-butyl N-{2-[(1R,3R)-3-(aminomethyl)-2,2-dimethylcyclopropyl]-4-hydroxyphenyl}carbamate
Methyl 2-amino-2-[1-(2-{[(tert-butoxy)carbonyl]amino}-5-hydroxyphenyl)cyclopropyl]acetate

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