Damascone
Damascone structure
|
Common Name | Damascone | ||
|---|---|---|---|---|
| CAS Number | 23726-91-2 | Molecular Weight | 192.297 | |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 271.2±10.0 °C at 760 mmHg | |
| Molecular Formula | C13H20O | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 108.0±14.0 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of Damasconeβ-Damascone is an aroma active rice volatile and is widely used in perfume compositions. β-Damascone has also received certain attention as a potential cancer chemopreventive and a mosquito and muscoid insecticide[1][2]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | β-Damascone |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | β-Damascone is an aroma active rice volatile and is widely used in perfume compositions. β-Damascone has also received certain attention as a potential cancer chemopreventive and a mosquito and muscoid insecticide[1][2]. |
|---|---|
| Related Catalog | |
| In Vitro | CYP101C1 is capable of binding and hydroxylating ionone derivatives including α- and β-ionone and β-damascone[3]. Several of the key flavor compounds in rose essential oil are C13-norisoprenoids, such asβ-damascenone, β-Damascone, and β-ionone which are derived from carotenoid degradation[4]. |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 271.2±10.0 °C at 760 mmHg |
| Molecular Formula | C13H20O |
| Molecular Weight | 192.297 |
| Flash Point | 108.0±14.0 °C |
| Exact Mass | 192.151413 |
| PSA | 17.07000 |
| LogP | 4.40 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.476 |
| InChIKey | BGTBFNDXYDYBEY-FNORWQNLSA-N |
| SMILES | CC=CC(=O)C1=C(C)CCCC1(C)C |
| Storage condition | 2-8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H317 |
| Precautionary Statements | P280 |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | R43 |
| Safety Phrases | 36/37 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 2 |
| RTECS | EN0340000 |
| HS Code | 29142990 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 1 | |
CAS#:35122-36-2
CAS#:39190-06-2
CAS#:77250-09-0
CAS#:77250-07-8
CAS#:35044-57-6
CAS#:23726-93-4
CAS#:79-77-6
CAS#:22029-76-1
CAS#:35044-62-3
CAS#:35044-59-8This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (2E)-1-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-2-en-1-one |
| (E)-b-Damascone |
| 4-(2.6.6-Trimethyl cyclohex-1-enyl)-but-2-en-4-one |
| Damascone |
| (2E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-buten-1-on |
| (2E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-buten-1-one |
| (2E)-1-(2,6,6-Triméthyl-1-cyclohexén-1-yl)-2-butén-1-one |
| trans-2,6,6-Trimethyl-1-crotonylcyclohex-1-ene |
| trans-b-Damascone |
| b-Damascone |
| β-Damascone |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of β-Damascone? |
| A: The English name of β-Damascone is β-Damascone. |
| Q: What is the boiling point of β-Damascone? |
| A: Boiling point of β-Damascone is 271.2±10.0 °C at 760 mmHg. |
| Q: What is the CAS number of β-Damascone? |
| A: CAS number of β-Damascone is 23726-91-2. |
| Q: What are the storage conditions for β-Damascone? |
| A: Storage conditions for β-Damascone: 2-8°C. |
| Q: What is the molecular formula of β-Damascone? |
| A: Molecular formula of β-Damascone is C13H20O. |
| Q: What are the upstream materials of β-Damascone? |
| A: Related upstream materials(CAS) of β-Damascone: 35122-36-2;39190-06-2;77250-09-0;77250-07-8;35044-57-6;23726-93-4;79-77-6;22029-76-1;35044-62-3;35044-59-8. |
| Q: What are the downstream products of β-Damascone? |
| A: Related downstream products(CAS) of β-Damascone: 23726-93-4. |
| Q: What is the safety information for β-Damascone? |
| A: Safety information for β-Damascone: 36/37. |
| Q: What is the SMILES notation of β-Damascone? |
| A: SMILES notation of β-Damascone is CC=CC(=O)C1=C(C)CCCC1(C)C. |
| Q: What is the molecular weight of β-Damascone? |
| A: Molecular weight of β-Damascone is 192.297. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| naturewill |