2,4-dinitrophenyl thiocyanate
Names
[ CAS No. ]:
1594-56-5
[ Name ]:
2,4-dinitrophenyl thiocyanate
[Synonym ]:
EINECS 216-477-5
MFCD00047702
(2,4-dinitrophenyl) thiocyanate
2,4-Dinitrophenyl Thiocyanate
2,4-Dinitrophenylrhodanide
Thiocyanic Acid 2,4-Dinitrophenyl Ester
Chemical & Physical Properties
[ Density]:
1.62g/cm3
[ Boiling Point ]:
368.4ºC at 760 mmHg
[ Melting Point ]:
138-140°C
[ Molecular Formula ]:
C7H3N3O4S
[ Molecular Weight ]:
225.18100
[ Exact Mass ]:
224.98400
[ PSA ]:
140.73000
[ LogP ]:
3.12258
[ Vapour Pressure ]:
1.28E-05mmHg at 25°C
[ Index of Refraction ]:
1.666
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XK9450000
- CHEMICAL NAME :
- Thiocyanic acid, 2,4-dinitrophenyl ester
- CAS REGISTRY NUMBER :
- 1594-56-5
- BEILSTEIN REFERENCE NO. :
- 1983292
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 15
- MOLECULAR FORMULA :
- C7-H3-N3-O4-S
- MOLECULAR WEIGHT :
- 225.19
- WISWESSER LINE NOTATION :
- WNR CNW DSCN
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 30 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 :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2750 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 :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 51 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 :
- Oral
- SPECIES OBSERVED :
- Rodent - guinea pig
- DOSE/DURATION :
- 1650 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 :
- Unreported
- SPECIES OBSERVED :
- Mammal - species unspecified
- DOSE/DURATION :
- 500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA
- TYPE OF TEST :
- Cytogenetic analysis
- TEST SYSTEM :
- Rodent - hamster Lung
- DOSE/DURATION :
- 10 umol/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 78,177,1980 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-HUNGARY:TWA 2 mg/m3;STEL 10 mg/m3 JAN 1993
Safety Information
[ Risk Phrases ]:
R32;R36/37/38
[ Safety Phrases ]:
S26-S36/37/39
[ RTECS ]:
XK9450000
[ Packaging Group ]:
III
[ HS Code ]:
2930909090
Synthetic Route
Precursor & DownStream
Precursor
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%