5339-39-9

5339-39-9 structure

Name: [4-(4-thiocyanatoanilino)phenyl] thiocyanate
Chemical Name: [4-(4-thiocyanatoanilino)phenyl] thiocyanate
CAS Number: 5339-39-9
Molecular Formula: C₁₄H₉N₃S₂
Molecular Weight: 283.37100
Create Date: 2017-04-24 21:41:16
Modify Date: 2024-01-08 15:31:55

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

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

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

HS Code	2930909090

1147550-11-5

122-39-4

~9%

16078-85-6

5339-39-9

Literature: Fotouhi, Lida; Nikoofar, Kobra Tetrahedron Letters, 2013 , vol. 54, # 23 p. 2903 - 2905

122-39-4

5339-39-9

Literature: Kaufmann; Oehring Chemische Berichte, 1926 , vol. 59, p. 190 Full Text Show Details I.G.Farbenind. Patent: DE484360 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 16, p. 434

122-39-4

592-87-0

5339-39-9

Literature: I.G.Farbenind. Patent: DE439604 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 15, p. 278

Precursor 2
122-39-4 592-87-0
DownStream 0

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%

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