Introduction：Basic information about CAS 67910-07-0|Homobaldrinal, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Homobaldrinal |
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| CAS Number | 67910-07-0 | Molecular Weight | 260.285 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 462.1±30.0 °C at 760 mmHg |
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| Molecular Formula | C15H16O4 | Melting Point | / |
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| MSDS | / | Flash Point | 207.4±24.6 °C |
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Names
| Name | (7-Formylcyclopenta[c]pyran-4-yl)methyl 3-methylbutanoate |
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| Synonym | More Synonyms |
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Homobaldrinal BiologicalActivity
| Description | Homobaldrinal is a decomposition product of Valepotriate (HY-N0718). Homobaldrinal exhibits genotoxic activity in the Salmonella/microsome test[1]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>OthersResearch Areas >>Neurological Disease |
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| References | [1]. W von der Hude, et al.Bacterial Mutagenicity of the Tranquilizing Constituents of Valerianaceae Roots. Mutat Res |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 462.1±30.0 °C at 760 mmHg |
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| Molecular Formula | C15H16O4 |
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| Molecular Weight | 260.285 |
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| Flash Point | 207.4±24.6 °C |
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| Exact Mass | 260.104858 |
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| PSA | 56.51000 |
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| LogP | 0.44 |
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| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
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| Index of Refraction | 1.555 |
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| InChIKey | LTVSLKWNAZKBEX-UHFFFAOYSA-N |
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| SMILES | CC(C)CC(=O)OCc1cocc2c(C=O)ccc1-2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EK7906000
- CHEMICAL NAME :
- Butanoic acid, 3-methyl-, (7-formylcyclopenta(c)pyran-4-yl)methyl ester
- CAS REGISTRY NUMBER :
- 67910-07-0
- LAST UPDATED :
- 199410
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C15-H16-O4
- MOLECULAR WEIGHT :
- 260.31
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA - TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Bacteria - Escherichia coli
- DOSE/DURATION :
- 100 nmol/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 169,23,1986
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Synonyms
| (7-Formylcyclopenta[c]pyran-4-yl)methyl 3-methylbutanoate |
| Butanoic acid, 3-methyl-, (7-formylcyclopenta[c]pyran-4-yl)methyl ester |
| BUTANOIC ACID,3-METHYL-,(7-FORMYLCYCLOPENTA(c)PYRAN-4-YL)METHYL ESTER |
| Homobaldrinal |
| I07-0300 |
