CAS Number538-58-9
SynonymsStyrol ketone; 1,5-diphenyl-1,4-pentadiene-3-one; MFCD00004790; DISTYRYL KETONE; 1,5-diphenylpenten-1,4-dien-3-one; 1,3-Dibenzylideneacetone; Bis(2-phenylvinyl) ketone; DIBENZAL ACETONE; 1,5-Diphenylpenta-1,4-dien-3-one; EINECS 208-697-5; 1,5-diphenyl pent-1,4-diene-3-one; Di(2-phenylvinyl) ketone
Molecular FormulaC17H14O
Molecular Weight234.301
Purity98.00%
Density1.1g/cm3
Boiling Point400.7ºC at 760 mmHg
Melting Point112-114ºC
Appearanceyellow powder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 538-58-9 |
| Catalog No. | 2A-9022704 |
| Chinese Name | 二亚苄叉丙酮DBA |
| Synonyms | Styrol ketone; 1,5-diphenyl-1,4-pentadiene-3-one; MFCD00004790; DISTYRYL KETONE; 1,5-diphenylpenten-1,4-dien-3-one; 1,3-Dibenzylideneacetone; Bis(2-phenylvinyl) ketone; DIBENZAL ACETONE; 1,5-Diphenylpenta-1,4-dien-3-one; EINECS 208-697-5; 1,5-diphenyl pent-1,4-diene-3-one; Di(2-phenylvinyl) ketone |
| Molecular Formula | C17H14O |
| Molecular Weight | 234.301 |
| Purity | 98.00 |
| Density | 1.1g/cm3 |
| Boiling Point | 400.7ºC at 760 mmHg |
| Melting Point | 112-114ºC |
| Appearance | yellow powder |
| Storage Condition | Store sealed at 0-6°C in a ventilated, dry place. |
| Application | Dibenzylideneacetone is a small molecule inhibitor of gray mold chitinase with an IC50 of 13.10 μg/mL. The MIC of Botrytis cinerea is 32 μg/mL, and the EC50 values for inhibiting mycelium growth and |
| MDL Number | MFCD00004790 |
| SMILES | O=C(C=Cc1ccccc1)C=Cc1ccccc1 |
| InChI | InChI=1S/C17H14O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-14H/b13-11+,14-12+ |
| InChI Key | WMKGGPCROCCUDY-AOGCGKDYSA-N |
| MSDS | msds/22704_1_538_58_9.pdf |
| Bioactivity | Dibenzylideneacetone is a small molecule inhibitor of Botrytis cinerea chitinase with an IC50 of 13.10 μg/mL. The MIC of Botrytis cinerea was 32 μg/mL, and the EC50 values for inhibiting mycelial growth and spore germination were 16.29 and 14.64 μg/mL, respectively. Dibenzylideneacetone is a potential antifungal agent for fruit preservation, which effectively extends the preservation time of cherries[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Anti-infection >> Bacterial Target Chitinase[1] References [1]. Niu X, Wang Z, Wang C, Wang H. Dibenzylideneacetone Overcomes Botrytis cinerea Infection in Cherry Tomatoes by Inhibiting Chitinase Activity. J Agric Food Chem. 2023 Nov 1. Chemical & Physical Properties Density 1.1g/cm3 Boiling Point 400.7ºC at 760 mmHg Melting Point 112-114ºC Molecular Formula C17H14O Molecular Weight 234.29200 Flash Point 176.2ºC Exact Mass 234.10400 PSA 17.07000 LogP 3.98230 Index of Refraction 1.649 InChIKey WMKGGPCROCCUDY-AOGCGKDYSA-N SMILES O=C(C=Cc1ccccc1)C=Cc1ccccc1 Storage condition 0-6°C Stability Stable. Incompatible with strong oxidizing agents. Combustible. |
| Use of | Dibenzylideneacetone is a small molecule inhibitor of Botrytis cinerea chitinase with an IC50 of 13.10 μg/mL. The MIC of Botrytis cinerea was 32 μg/mL, and the EC50 values for inhibiting mycelial growth and spore germination were 16.29 and 14.64 μg/mL, respectively. Dibenzylideneacetone is a potential antifungal agent for fruit preservation, which effectively extends the preservation time of cherries[1]. Properties Name 1,5-Diphenyl-3-pentadienone Synonym More Synonyms dibenzylideneacetone Biological Activity Description Dibenzylideneacetone is a small molecule inhibitor of Botrytis cinerea chitinase with an IC50 of 13.10 μg/mL. The MIC of Botrytis cinerea was 32 μg/mL, and the EC50 values for inhibiting mycelial growth and spore germination were 16.29 and 14.64 μg/mL, respectively. Dibenzylideneacetone is a potential antifungal agent for fruit preservation, which effectively extends the preservation time of cherries[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Anti-infection >> Bacterial Chitinase[1] References [1]. Niu X, Wang Z, Wang C, Wang H. Dibenzylideneacetone Overcomes Botrytis cinerea Infection in Cherry Tomatoes by Inhibiting Chitinase Activity. J Agric Food Chem. 2023 Nov 1. Chemical & Physical Properties Molecular Formula C17H14O Exact Mass 234.10400 PSA 17.07000 LogP 3.98230 Index of Refraction 1.649 InChIKey WMKGGPCROCCUDY-AOGCGKDYSA-N Stability Stable. Incompatible with strong oxidizing agents. Combustible. |
| Transport Info | Product name: Dibenzylideneacetone DBA |
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| 2-Benzyl-2-thiopseudourea hydrochloride | 538-28-3 | 2A-9022699 |
| Benzylurea | 538-32-9 | 2A-9022700 |
| 3-Phenoxy-1,2-propanediol | 538-43-2 | 2A-9022702 |
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| Dibenzyl sulphide | 538-74-9 | 2A-9022707 |
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| 4-Methylphenylhydrazine | 539-44-6 | 2A-9022715 |
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