CAS 462-06-6|Fluorobenzene
| Common Name | Fluorobenzene | ||
|---|---|---|---|
| CAS Number | 462-06-6 | Molecular Weight | 96.102 |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 84.7±9.0 °C at 760 mmHg |
| Molecular Formula | C6H5F | Melting Point | -42 °C |
| MSDS | ChineseUSA | Flash Point | -12.8±0.0 °C |
| Symbol | GHS02, GHS07 | Signal Word | Danger |
Names
| Name | monofluorobenzene |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 84.7±9.0 °C at 760 mmHg |
| Melting Point | -42 °C |
| Molecular Formula | C6H5F |
| Molecular Weight | 96.102 |
| Flash Point | -12.8±0.0 °C |
| Exact Mass | 96.037529 |
| LogP | 2.27 |
| Vapour density | 3.31 (vs air) |
| Vapour Pressure | 79.9±0.1 mmHg at 25°C |
| Index of Refraction | 1.473 |
| InChIKey | PYLWMHQQBFSUBP-UHFFFAOYSA-N |
| SMILES | Fc1ccccc1 |
| Stability | Stable. Incompatible with oxidizing agents. Highly flammable - note low flash point. |
| Water Solubility | INSOLUBLE |
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 :
- 4399 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 19(9),36,1975
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 26908 mg/m3
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 19(9),36,1975
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 45 gm/m3/2H
- TOXIC EFFECTS :
- Behavioral - tremor Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- IZSBAI Izvestiya Sibirskogo Otdeleniya Akademii Nauk SSSR, Seriya Biologomeditsinskikh Nauk. (Novosibirsk, USSR) No.1-3, 1963-68. For publisher information, see ISBNBN. Volume(issue)/page/year: 3,91,1965 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4678 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 28 (estimated)
Safety Information
| Symbol | GHS02, GHS07 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H225-H319-H412 |
| Precautionary Statements | P210-P273-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | F:Flammable |
| Risk Phrases | R11;R36/37/38 |
| Safety Phrases | S16-S26-S36-S7-S33-S29-S45-S36/37-S61 |
| RIDADR | UN 2387 3/PG 2 |
| WGK Germany | 2 |
| RTECS | DA0800000 |
| Packaging Group | II |
| Hazard Class | 3 |
| HS Code | 2903999090 |
Customs
| HS Code | 2903999090 |
|---|---|
| Summary | 2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
Articles6
More Articles| Convenient QSAR model for predicting the complexation of structurally diverse compounds with β-cyclodextrins Bioorg. Med. Chem. 17 , 896-904, (2009) This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoret... | |
| Calculating virtual log P in the alkane/water system (log P(N)(alk)) and its derived parameters deltalog P(N)(oct-alk) and log D(pH)(alk). J. Med. Chem. 48 , 3269-79, (2005) Growing interest in the use of both the logarithm of the partition coefficient of the neutral species in the alkane/water system (log P(N)(alk)) and the difference between log P(N)(oct) (the logarithm... | |
| QSPR modeling of octanol/water partition coefficient for vitamins by optimal descriptors calculated with SMILES. Eur. J. Med. Chem. 43 , 714-40, (2008) Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and org... |
Synonyms
| Monofluorobenzene |
| monofluoro boroxine |
| 4-fluorobenzene |
| EINECS 207-321-7 |
| Monofluorboroxin |
| 1-fluorobenzene |
| p-fluorobenzene |
| 2-fluorobenzene |
| MFCD00000280 |
| Fluorobenzene |
| o-di-fluorobenzene |
| FLUOROBOROXIN |
| BENZENYL FLUORIDE |
| Fluorobenzene [UN2387] [Flammable liquid] |
| Benzene, fluoro- |
