Thiocyanic acid, (4-chlorophenyl)methyl ester
Names
[ CAS No. ]:
2082-64-6
[ Name ]:
Thiocyanic acid, (4-chlorophenyl)methyl ester
[Synonym ]:
Thiocyanic acid,4-chlorobenzyl ester
4-Chlor-benzylthiocyanat
4-ClC6H4CH2SCN
p-chlorobenzyl thiocyanate
1-chloro-4-thiocyanatomethyl-benzene
Chemical & Physical Properties
[ Density]:
1.297g/cm3
[ Boiling Point ]:
291.3ºC at 760 mmHg
[ Molecular Formula ]:
C8H6ClNS
[ Molecular Weight ]:
183.65800
[ Flash Point ]:
130ºC
[ Exact Mass ]:
182.99100
[ PSA ]:
49.09000
[ LogP ]:
3.05428
[ Vapour Pressure ]:
0.00196mmHg at 25°C
[ Index of Refraction ]:
1.602
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XK8562000
- CHEMICAL NAME :
- Thiocyanic acid, 4-chlorobenzyl ester
- CAS REGISTRY NUMBER :
- 2082-64-6
- BEILSTEIN REFERENCE NO. :
- 2209283
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C8-H6-Cl-N-S
- MOLECULAR WEIGHT :
- 183.66
- WISWESSER LINE NOTATION :
- NCS1R DG
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 40 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 16,870,1966
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 40 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 21,121,1971
Safety Information
[ 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%