Introduction：Basic information about CAS 3778-85-6|Carbamimidothioic acid,(2-chlorophenyl)methyl ester, hydrochloride (1:1), including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Carbamimidothioic acid,(2-chlorophenyl)methyl ester, hydrochloride (1:1) |
|---|
| CAS Number | 3778-85-6 | Molecular Weight | 237.14900 |
|---|
| Density | 1.33g/cm3 | Boiling Point | 315.9ºC at 760 mmHg |
|---|
| Molecular Formula | C8H10Cl2N2S | Melting Point | / |
|---|
| MSDS | / | Flash Point | 144.9ºC |
|---|
Names
| Name | (2-chlorophenyl)methyl carbamimidothioate,hydrochloride |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.33g/cm3 |
|---|
| Boiling Point | 315.9ºC at 760 mmHg |
|---|
| Molecular Formula | C8H10Cl2N2S |
|---|
| Molecular Weight | 237.14900 |
|---|
| Flash Point | 144.9ºC |
|---|
| Exact Mass | 235.99400 |
|---|
| PSA | 75.17000 |
|---|
| LogP | 4.06870 |
|---|
| Index of Refraction | 1.625 |
|---|
| InChIKey | CEICVYXCGHTEIT-UHFFFAOYSA-N |
|---|
| SMILES | Cl.N=C(N)SCc1ccccc1Cl |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UM0940500
- CHEMICAL NAME :
- Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride
- CAS REGISTRY NUMBER :
- 3778-85-6
- LAST UPDATED :
- 199007
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H9-Cl-N2-S.Cl-H
- MOLECULAR WEIGHT :
- 237.16
- WISWESSER LINE NOTATION :
- MUYZS1R BG &GH
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 43 mg/kg
- TOXIC EFFECTS :
- Behavioral - general anesthetic
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 10,649,1967
|
Safety Information
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% |
|---|
Synonyms
| 2-chlorophenylmethyl carbamimidothioate hydrochloride |
| 2-chlorobenzylisothiourea hydrochloride |
| 2-chlorobenzyl imidothiocarbamate |
