Introduction：Basic information about CAS 584-02-1|Pentan-3-ol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pentan-3-ol |
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| CAS Number | 584-02-1 | Molecular Weight | 88.148 |
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| Density | 0.8±0.1 g/cm3 | Boiling Point | 115.3±0.0 °C at 760 mmHg |
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| Molecular Formula | C5H12O | Melting Point | -75 °C |
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| MSDS | ChineseUSA | Flash Point | 40.6±0.0 °C |
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| Symbol |
GHS02, GHS07 | Signal Word | Warning |
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Names
| Name | 3-pentanol |
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| Synonym | More Synonyms |
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Pentan-3-ol BiologicalActivity
| Description | 3-Pentanol is an active organic compound produced by plants and is a component of emitted insect sex pheromones. 3-pentanol elicits plant immunity against microbial pathogens and an insect pest in crop plants[1]. |
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| Related Catalog | Research Areas >>InfectionSignaling Pathways >>Anti-infection >>Bacterial |
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| References | [1]. Geun C Song, et al. Gaseous 3-pentanol primes plant immunity against a bacterial speck pathogen, Pseudomonas syringae pv. tomato via salicylic acid and jasmonic acid-dependent signaling pathways in Arabidopsis. Front Plant Sci. 2015 Oct 6;6:821. |
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Chemical & Physical Properties
| Density | 0.8±0.1 g/cm3 |
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| Boiling Point | 115.3±0.0 °C at 760 mmHg |
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| Melting Point | -75 °C |
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| Molecular Formula | C5H12O |
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| Molecular Weight | 88.148 |
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| Flash Point | 40.6±0.0 °C |
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| Exact Mass | 88.088814 |
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| PSA | 20.23000 |
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| LogP | 1.22 |
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| Vapour Pressure | 9.7±0.4 mmHg at 25°C |
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| Index of Refraction | 1.405 |
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| InChIKey | JYVLIDXNZAXMDK-UHFFFAOYSA-N |
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| SMILES | CCCC(C)O |
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| Stability | Stable. Combustible. Incompatible with strong oxidizing agents. |
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| Water Solubility | 5.5 g/100 mL (30 ºC) |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- SA5075000
- CHEMICAL NAME :
- 3-Pentanol
- CAS REGISTRY NUMBER :
- 584-02-1
- BEILSTEIN REFERENCE NO. :
- 1730964
- LAST UPDATED :
- 199806
- DATA ITEMS CITED :
- 8
- MOLECULAR FORMULA :
- C5-H12-O
- MOLECULAR WEIGHT :
- 88.17
- WISWESSER LINE NOTATION :
- QY2&2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,197,1986
- TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,197,1986 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1870 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 10,61,1954
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1950 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JIHTAB Journal of Industrial Hygiene and Toxicology. (Cambridge, MA) V.18-31, 1936-49. For publisher information, see AEHLAU. Volume(issue)/page/year: 27,1,1945
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 2520 uL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 10,61,1954 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-DENMARK:TWA 100 ppm (360 mg/m3) JAN 1993 OEL-POLAND:TWA 100 mg/m3;STEL 450 mg/m3 JAN 1993
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Safety Information
| Symbol |
GHS02, GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H226-H315-H332-H335 |
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| Precautionary Statements | P261 |
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| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
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| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R10;R20;R37;R66 |
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| Safety Phrases | S46 |
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| RIDADR | UN 1105 3/PG 3 |
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| WGK Germany | 1 |
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| RTECS | SA5075000 |
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| Packaging Group | III |
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| Hazard Class | 3 |
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| HS Code | 29051500 |
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Customs
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Synonyms
| EINECS 209-526-7 |
| pentan-3-ol |
| 4-01-00-01662 (Beilstein Handbook Reference) |
| sec-Amyl Alcohol |
| 1-ethylpropanol |
| 3-Hydroxy-pentan-2,4-dion |
| sec-Pentanol |
| sec-Pentyl alcohol |
| 3-hydroxypentane |
| 3-Pentyl alcohol |
| 3-hydroxy-pentane-2,4-dione |
| diethyl carbinol |
| 3-Pentanol |
| methylbutan-2-ol |
| MFCD00004574 |
| n-pentan-3-ol |
