Introduction：Basic information about CAS 100-29-8|1-Ethoxy-4-nitrobenzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-Ethoxy-4-nitrobenzene |
|---|
| CAS Number | 100-29-8 | Molecular Weight | 167.162 |
|---|
| Density | 1.2±0.1 g/cm3 | Boiling Point | 283.0±0.0 °C at 760 mmHg |
|---|
| Molecular Formula | C8H9NO3 | Melting Point | 56-60 °C |
|---|
| MSDS | / | Flash Point | 134.1±21.8 °C |
|---|
Names
| Name | 1-Ethoxy-4-nitrobenzene |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
|---|
| Boiling Point | 283.0±0.0 °C at 760 mmHg |
|---|
| Melting Point | 56-60 °C |
|---|
| Molecular Formula | C8H9NO3 |
|---|
| Molecular Weight | 167.162 |
|---|
| Flash Point | 134.1±21.8 °C |
|---|
| Exact Mass | 167.058243 |
|---|
| PSA | 55.05000 |
|---|
| LogP | 2.56 |
|---|
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
|---|
| Index of Refraction | 1.535 |
|---|
| InChIKey | NWPKEYHUZKMWKJ-UHFFFAOYSA-N |
|---|
| SMILES | CCOc1ccc([N+](=O)[O-])cc1 |
|---|
| Stability | Stable. Incompatible with strong oxidizing agents. |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DA0600000
- CHEMICAL NAME :
- Benzene, 1-ethoxy-4-nitro-
- CAS REGISTRY NUMBER :
- 100-29-8
- BEILSTEIN REFERENCE NO. :
- 0972473
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 10
- MOLECULAR FORMULA :
- C8-H9-N-O3
- MOLECULAR WEIGHT :
- 167.18
- WISWESSER LINE NOTATION :
- WNR DO2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 3300 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Lungs, Thorax, or Respiration - other changes Blood - hemorrhage
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >16 gm/kg
- TOXIC EFFECTS :
- Liver - fatty liver degeneration Kidney, Ureter, Bladder - other changes
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2100 mg/kg
- TOXIC EFFECTS :
- Behavioral - general anesthetic Lungs, Thorax, or Respiration - respiratory depression Blood - other changes
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >7940 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - food intake (animal)
MUTATION DATA - TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Bacteria - Bacillus subtilis
- DOSE/DURATION :
- 5 mg/disc
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 170,11,1986 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4374 No. of Facilities: 6 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 206 (estimated) No. of Female Employees: 23 (estimated)
|
Safety Information
| Hazard Codes | Xi |
|---|
| Safety Phrases | S24/25-S22 |
|---|
| RTECS | DA0600000 |
|---|
| HS Code | 2909309090 |
|---|
Customs
| HS Code | 2909309090 |
|---|
| Summary | 2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
|---|
Synonyms
| 4-NITROPHENETOL |
| 1-Ethoxy-4-nitrobenzene |
| Ethyl p-nitrophenyl ether |
| 4-Nitrophenetole |
| p-nitroethoxybenzene |
| EINECS 202-837-9 |
| Ethyl 4-nitrophenyl ether |
| Benzene, 1-ethoxy-4-nitro- |
| MFCD00007330 |
| 1-Ethoxy-4-nitro-benzene |
| Phenetole, p-nitro- |
