Introduction：Basic information about CAS 622-04-8|1,3-Diphenoxy-2-propanol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,3-Diphenoxy-2-propanol |
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| CAS Number | 622-04-8 | Molecular Weight | 244.28600 |
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| Density | 1.148 g/cm3 | Boiling Point | 396.8ºC at 760 mmHg |
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| Molecular Formula | C15H16O3 | Melting Point | 80-82ºC |
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| MSDS | / | Flash Point | 193.8ºC |
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Names
| Name | 1,3-Diphenoxy-2-propanol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.148 g/cm3 |
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| Boiling Point | 396.8ºC at 760 mmHg |
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| Melting Point | 80-82ºC |
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| Molecular Formula | C15H16O3 |
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| Molecular Weight | 244.28600 |
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| Flash Point | 193.8ºC |
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| Exact Mass | 244.11000 |
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| PSA | 38.69000 |
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| LogP | 2.50530 |
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| Index of Refraction | 1.571 |
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| InChIKey | NKCVHIPHZCIEFC-UHFFFAOYSA-N |
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| SMILES | OC(COc1ccccc1)COc1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UB4100000
- CHEMICAL NAME :
- 2-Propanol, 1,3-diphenoxy-
- CAS REGISTRY NUMBER :
- 622-04-8
- BEILSTEIN REFERENCE NO. :
- 1882894
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C15-H16-O3
- MOLECULAR WEIGHT :
- 244.31
- WISWESSER LINE NOTATION :
- RO1YQ1OR
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Open irritation test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- 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: 4,119,1951
- 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: -,646,1986 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1450 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: 4,119,1951
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04474
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 15800 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: 4,119,1951
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Safety Information
| Risk Phrases | R22 |
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| Safety Phrases | S26;S36/S37 |
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| HS Code | 2909499000 |
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Customs
| HS Code | 2909499000 |
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| Summary | 2909499000. ether-alcohols and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| MFCD00091115 |
| EINECS 210-718-8 |
| 1,3-diphenoxypropan-2-ol |
