Introduction：Basic information about CAS 94-14-4|Isobutamben, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Isobutamben |
|---|
| CAS Number | 94-14-4 | Molecular Weight | 193.24200 |
|---|
| Density | / | Boiling Point | / |
|---|
| Molecular Formula | C11H15NO2 | Melting Point | 65°C |
|---|
| MSDS | / | Flash Point | / |
|---|
Names
| Name | Isobutyl 4-Aminobenzoate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Melting Point | 65°C |
|---|
| Molecular Formula | C11H15NO2 |
|---|
| Molecular Weight | 193.24200 |
|---|
| Exact Mass | 193.11000 |
|---|
| PSA | 52.32000 |
|---|
| LogP | 2.66280 |
|---|
| InChIKey | PUYOAVGNCWPANW-UHFFFAOYSA-N |
|---|
| SMILES | CC(C)COC(=O)c1ccc(N)cc1 |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DG2955000
- CHEMICAL NAME :
- Benzoic acid, p-amino-, (2-methylpropyl) ester
- CAS REGISTRY NUMBER :
- 94-14-4
- BEILSTEIN REFERENCE NO. :
- 2804349
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C11-H15-N-O2
- MOLECULAR WEIGHT :
- 193.27
- WISWESSER LINE NOTATION :
- ZR DVO1Y1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 48 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- 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: 17,900,1974
|
Safety Information
| RTECS | DG2955000 |
|---|
| HS Code | 2922499990 |
|---|
Customs
| HS Code | 2922499990 |
|---|
| Summary | HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0% |
|---|
Synonyms
| MFCD00017110 |
| EINECS 202-308-2 |
| 2-methylpropyl 4-aminobenzoate |
