[4,4'-Bi-7H-benz[de]anthracene]-7,7'-dione
![[4,4'-Bi-7H-benz[de]anthracene]-7,7'-dione Structure](https://image.chemsrc.com/caspic/166/116-90-5.png)
[4,4'-Bi-7H-benz[de]anthracene]-7,7'-dione structure
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Common Name | [4,4'-Bi-7H-benz[de]anthracene]-7,7'-dione | ||
|---|---|---|---|---|
| CAS Number | 116-90-5 | Molecular Weight | 458.50600 | |
| Density | 1.373g/cm3 | Boiling Point | 712.2ºC at 760 mmHg | |
| Molecular Formula | C34H18O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 252.5ºC | |
Summary: 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one (Chinese name: 4-(7-氧化苯[a]菲南-4-基)苯[a]菲南-7-酮，CAS number: 116-90-5，molecular formula: C34H18O2)，for research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.373g/cm3 |
|---|---|
| Boiling Point | 712.2ºC at 760 mmHg |
| Molecular Formula | C34H18O2 |
| Molecular Weight | 458.50600 |
| Flash Point | 252.5ºC |
| Exact Mass | 458.13100 |
| PSA | 34.14000 |
| LogP | 8.08280 |
| Vapour Pressure | 3.95E-20mmHg at 25°C |
| Index of Refraction | 1.793 |
| InChIKey | FEQOTXWZPMPKGW-UHFFFAOYSA-N |
| SMILES | O=C1c2ccccc2-c2cccc3c(-c4ccc5c6c(cccc46)-c4ccccc4C5=O)ccc1c23 |
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.
| HS Code | 2914690090 |
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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 9 | |
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| DownStream 3 | |
CAS#:82-05-3
CAS#:82-04-2
CAS#:1865-45-8
CAS#:100-61-8
CAS#:64-17-5
CAS#:95-50-1
CAS#:67-63-0
CAS#:71-43-2
CAS#:108-90-7
CAS#:116-71-2
CAS#:128-64-3
CAS#:128-59-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914690090 |
|---|---|
| Summary | 2914690090 other quinones。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| [4,4'-bi-7H-benz(de)anthracene]-7,7'-dione |
| Benzanthronyl |
| EINECS 204-164-6 |
| 4,4'-Dibenzanthronyl |
| [4,4']Bi(benz[de]anthracenyl)-7,7'-dion |
| [4,4']bi[benz[de]anthracenyl]-7,7'-dione |
| 4,4'-bibenzanthronyl |
| 7H-Benz(de)anthracen-7-one,4,4'-di |
| 4,4'-Dibenzanthronil |
| Dibenzonyl |
| Dibenzanthronyl-(2.2') |
| <2.2'>Bibenzanthronyl |
| 4,4'-Di-7H-benz(de)anthracen-7-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: Polar surface area (PSA) of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one is 34.14000. |
| Q: What English synonyms does 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one have? |
| A: English synonyms of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one: [4,4'-bi-7H-benz(de)anthracene]-7,7'-dione, Benzanthronyl, EINECS 204-164-6, 4,4'-Dibenzanthronyl, [4,4']Bi(benz[de]anthracenyl)-7,7'-dion, [4,4']bi[benz[de]anthracenyl]-7,7'-dione, 4,4'-bibenzanthronyl, 7H-Benz(de)anthracen-7-one,4,4'-di, 4,4'-Dibenzanthronil, Dibenzonyl, Dibenzanthronyl-(2.2'), Bibenzanthronyl, 4,4'-Di-7H-benz(de)anthracen-7-one. |
| Q: What is the molecular weight of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: Molecular weight of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one is 458.50600. |
| Q: What is the boiling point of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: Boiling point of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one is 712.2ºC at 760 mmHg. |
| Q: What is the CAS number of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: CAS number of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one is 116-90-5. |
| Q: What is the InChIKey of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: InChIKey of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one is FEQOTXWZPMPKGW-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: Related upstream materials(CAS) of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one: 82-05-3;82-04-2;1865-45-8;100-61-8;64-17-5;95-50-1;67-63-0;71-43-2;108-90-7. |
| Q: What are the downstream products of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: Related downstream products(CAS) of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one: 116-71-2;128-64-3;128-59-6. |
| Q: What is the SMILES notation of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one? |
| A: SMILES notation of 4-(7-oxobenzo[a]phenalen-4-yl)benzo[a]phenalen-7-one is O=C1c2ccccc2-c2cccc3c(-c4ccc5c6c(cccc46)-c4ccccc4C5=O)ccc1c23. |
| Q: What is the Chinese name of 116-90-5? |
| A: Chinese name of 116-90-5 is 116-90-5. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |