Introduction:Basic information about CAS 3160-37-0|3,4-(methylenedioxy)benzylideneacetone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,4-(methylenedioxy)benzylideneacetone |
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| CAS Number | 3160-37-0 | Molecular Weight | 190.19500 |
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| Density | 1.225g/cm3 | Boiling Point | 335.1ºC at 760mmHg |
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| Molecular Formula | C11H10O3 | Melting Point | 108-110°C |
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| MSDS | / | Flash Point | 147.6ºC |
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Names
| Name | (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.225g/cm3 |
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| Boiling Point | 335.1ºC at 760mmHg |
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| Melting Point | 108-110°C |
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| Molecular Formula | C11H10O3 |
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| Molecular Weight | 190.19500 |
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| Flash Point | 147.6ºC |
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| Exact Mass | 190.06300 |
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| PSA | 35.53000 |
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| LogP | 2.01750 |
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| Index of Refraction | 1.598 |
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| InChIKey | XIYPXOFSURQTTJ-NSCUHMNNSA-N |
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| SMILES | CC(=O)C=Cc1ccc2c(c1)OCO2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EM9822500
- CHEMICAL NAME :
- 3-Buten-2-one, 4-(1,3-benzodioxol-5-yl)-
- CAS REGISTRY NUMBER :
- 3160-37-0
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C11-H10-O3
- MOLECULAR WEIGHT :
- 190.21
- WISWESSER LINE NOTATION :
- T56 BO DO CHJ G2V1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,847,1976
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >2 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 13,41,1978
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Safety Information
| Safety Phrases | S22-S24/25 |
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| RTECS | EM9822500 |
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Synonyms
| Piperonylidene acetone |
| 2-Butanone,4-(3,4-(methylenedioxy)phenyl) |
| Piperonalacetone |
| Heliotropyl acetone |
| EINECS 221-608-4 |
| 4-(benzo[d][1,3]dioxol-5-yl)but-3-en-2-one |
| 3,4-dioxymethylenebenzalacetone |
| 3,4-methylenedioxybenzylidene |
| 4-Benzo[1,3]dioxol-5-yl-but-3-en-2-on |
| 3,4-(methylenedioxy)benzylideneacetone |
| MFCD00016907 |
| 4-benzo[1,3]dioxol-5-yl-but-3-en-2-one |
| 4-(3',4'-Methylendioxy-phenyl)-buten-3-on-2 |
| Acetone,piperonylidene |
| 3,4-Methylenedioxybenzyl acetone |