Introduction：Basic information about CAS 471-77-2|neo-Abietic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | neo-Abietic acid |
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| CAS Number | 471-77-2 | Molecular Weight | 302.451 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 433.4±44.0 °C at 760 mmHg |
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| Molecular Formula | C20H30O2 | Melting Point | / |
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| MSDS | / | Flash Point | 206.0±23.1 °C |
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Names
| Name | Neoabietic acid |
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| Synonym | More Synonyms |
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neo-Abietic acid BiologicalActivity
| Description | Neoabietic acid is an abietic-type acid isolated from the oleoresin and rosin of Pinus palustris. Neoabietic acid is highly susceptible to mineral acid. Neoabietic acid has antibacterial activity in vitro[1][2][3]. |
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| Related Catalog | Research Areas >>InfectionSignaling Pathways >>Anti-infection >>Bacterial |
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| References | [1]. HARRIS GC, et, al. Resin acids; an improved method of isolation of resin acids the isolation of a new abietic-type acid, neoabietic acid. J Am Chem Soc. 1948 Jan; 70(1): 334-9. [2]. Jagalski V, et, al. Biophysical study of resin acid effects on phospholipid membrane structure and properties. Biochim Biophys Acta. 2016 Nov; 1858(11):2827-2838. [3]. Söderberg TA, et, al. Antibacterial activity of rosin and resin acids in vitro. Scand J Plast Reconstr Surg Hand Surg. 1990; 24(3): 199-205. |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 433.4±44.0 °C at 760 mmHg |
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| Molecular Formula | C20H30O2 |
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| Molecular Weight | 302.451 |
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| Flash Point | 206.0±23.1 °C |
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| Exact Mass | 302.224579 |
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| PSA | 37.30000 |
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| LogP | 6.67 |
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| Vapour Pressure | 0.0±2.2 mmHg at 25°C |
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| Index of Refraction | 1.542 |
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| InChIKey | KGMSWPSAVZAMKR-ONCXSQPRSA-N |
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| SMILES | CC(C)=C1C=C2CCC3C(C)(C(=O)O)CCCC3(C)C2CC1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- TP8740000
- CHEMICAL NAME :
- Podocarp-8(14)-en-15-oic acid, 13-isopropylidene-
- CAS REGISTRY NUMBER :
- 471-77-2
- BEILSTEIN REFERENCE NO. :
- 2702391
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C20-H30-O2
- MOLECULAR WEIGHT :
- 302.50
- WISWESSER LINE NOTATION :
- L B666 EY FUTJ A1 EUY1&1 KVQ K1
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA - TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Yeast - Schizosaccharomyces pombe
- DOSE/DURATION :
- 90 nmol/L
- REFERENCE :
- CNJGA8 Canadian Journal of Genetics and Cytology. (National Research Council of Canada, Publication Sales and Distribution, Ottawa ON K1A OR6, Canada) V.1- 1959- Volume(issue)/page/year: 24,771,1982
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Safety Information
| Hazard Codes | Xi |
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| Risk Phrases | 36/37/38 |
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| WGK Germany | 3 |
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| RTECS | TP8740000 |
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Synonyms
| 8(14),13(15)-Abietadien-18-oic acid |
| [1theta-(1alpha,4abeta,4balpha,10aalpha)]-methyl-7-(1-methylethylidene) |
| Abieta-8(14),13(15)-dien-18-oic acid |
| Podocarp-8(14)-en-15-oic acid, 13-isopropylidene- |
| neo-Abietic acid |
| NEOABIETIC ACID,STANDARD FOR GC |
| Abieta-8(14),13(15)-dien-18-saeure |
| 13-Isopropylidenepodocarp-8(14)-en-18-oic acid |
| 13-isopropylidene-podocarp-8(14)-en-15-oicaci |
| 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, (1R,4aR,4bS,10aR)- |
| Podocarp-8(14)-en-15-oic acid,13-isopropylidene |
| CTCM 189 |
| Abietadien-(8(14).13(15))-saeure-(18) |
| Neoabietinsaeure |
| Neoabietsaeure |
