CAS 274-09-9|1,3-Benzodioxole
Introduction：Basic information about CAS 274-09-9|1,3-Benzodioxole, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,3-Benzodioxole | ||
|---|---|---|---|
| CAS Number | 274-09-9 | Molecular Weight | 122.121 |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 173.0±15.0 °C at 760 mmHg |
| Molecular Formula | C7H6O2 | Melting Point | -18 °C |
| MSDS | ChineseUSA | Flash Point | 55.0±0.0 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 1,3-benzodioxole |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 173.0±15.0 °C at 760 mmHg |
| Melting Point | -18 °C |
| Molecular Formula | C7H6O2 |
| Molecular Weight | 122.121 |
| Flash Point | 55.0±0.0 °C |
| Exact Mass | 122.036781 |
| PSA | 18.46000 |
| LogP | 2.08 |
| Vapour Pressure | 1.7±0.3 mmHg at 25°C |
| Index of Refraction | 1.558 |
| InChIKey | FTNJQNQLEGKTGD-UHFFFAOYSA-N |
| SMILES | c1ccc2c(c1)OCO2 |
| Storage condition | -20°C |
| Water Solubility | 0.2 g/100 mL (25 ºC) |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 580 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - excitement
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 7,18,1965
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1220 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - coma Skin and Appendages - hair
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 2,327,1964 ** OTHER MULTIPLE DOSE TOXICITY DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 15 gm/kg/60D-I
- TOXIC EFFECTS :
- Related to Chronic Data - death
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 7,18,1965
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 + H332 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful |
| Risk Phrases | R10;R22 |
| Safety Phrases | S23-S24/25-S36/37/39-S26-S16 |
| RIDADR | UN 1993 3/PG 3 |
| WGK Germany | 3 |
| RTECS | DA5600000 |
| Packaging Group | III |
| Hazard Class | 3 |
| HS Code | 29329970 |
Customs
| HS Code | 2932999099 |
|---|---|
| Summary | 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
Articles24
More Articles| Smooth photocatalytic preparation of 2-substituted 1,3-benzodioxoles. Chemistry 17(2) , 572-9, (2011) A mild and general method for the synthesis of potentially bioactive 2-substituted-1,3-benzodioxoles is presented. This is based on the photocatalyzed activation of methylene hydrogen atoms in the pre... | |
| Computer graphics analysis of the interaction of alkoxy methylenedioxybenzenes with cytochromes P4501. Toxicol. Lett. 76(1) , 39-45, (1995) A quantitative structure-activity relationship (QSAR) in a homologous series of alkoxy methylenedioxybenzenes (MDBs) is reported. Measurements of molecular dimensions from computer-generated space-fil... | |
| Synthesis and cytotoxicity of podophyllotoxin analogues modified in the A ring. Eur. J. Med. Chem. 38(1) , 65-74, (2003) Several podophyllotoxin derivatives lacking the methylenedioxy group or with different functionalization of the A-ring of the cyclolignan skeleton have been prepared and evaluated for their cytotoxic ... |
Synonyms
| MFCD00005818 |
| EINECS 205-992-0 |
| Methylenedioxy benzene |
| 1,3-Benzodioxole |
| 1,2-Methylenedioxybenzene |
| 3,4-Methylenedioxybenzene |
| T56 BO DO CHJ |
| Benzo[d][1,3]dioxole |
| 1,2-(Methylenedioxy)benzene |
| 1,3-benzodioxolan |
| Methylenedioxybenzene |
| 1,3-Dioxindan |
| 1,3-Dioxaindan |
| Benzodioxole |
| Paroxetine Impurity 12 |
