3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione (CAS 63165-91-3) — formula C36H46O4, molecular weight 542.7; category organic chemicals.
| CAS Number | 63165-91-3 |
|---|---|
| Molecular Formula | C36H46O4 |
| Molecular Weight | 542.7 |
| LogP | 7.2 |
| Category | Organic Chemicals |
3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione is a carbon-based organic compound with CAS registry number 63165-91-3 and molecular formula C36H46O4 (molecular weight 542.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 63165-91-3
Its molecular formula C36H46O4 comprises 36 C, 46 H, 4 O atoms.
Also known as: 3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione · 3-[2,3-双[3,5-双(1,1-二甲基乙基)-4-氧代-2,5-环己二烯-1-亚基]亚环丙基]-2,4-戊二酮
Category: organic chemicals
The CAS registry number of 3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione is 63165-91-3.
Molecular formula C36H46O4, molecular weight 542.7.
It is also registered under: 3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione, 3-[2,3-双[3,5-双(1,1-二甲基乙基)-4-氧代-2,5-环己二烯-1-亚基]亚环丙基]-2,4-戊二酮.
Category: Organic Chemicals.
Independent reference data for 3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione (CAS 63165-91-3), compiled from public chemistry databases.
| CAS 号 | 63165-91-3 |
|---|---|
| PubChem CID | 113107 |
| 分子式 | C36H46O4 |
| IUPAC 名称 | 3-[2,3-bis(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclopropylidene]pentane-2,4-dione |
| Molecular Weight | 542.7 |
|---|---|
| XLogP3 | 7.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 542.33960994 |
| Monoisotopic Mass | 542.33960994 |
| Topological Polar Surface Area | 68.3 |
| Heavy Atom Count | 40 |
2,4-Pentanedione, 3-[bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-; 2,4-Pentanedione, 3-(2,3-bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)-; 2,4-Pentanedione, 3-(bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)-; 3-(Bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)-2,4-pentanedione; 2,4-Pentanedione, 3-[2,3-bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-; RefChem:443966; 63165-91-3; 3-[bis(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclopropylidene]pentane-2,4-dione; DTXSID5069754; SCHEMBL11525730; BYEOJXWRIUWHMD-UHFFFAOYSA-N; 3-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2,4-pentanedione; DB-217879
3-[2,3-双[3,5-双(1,1-二甲基乙基)-4-氧代-2,5-环己二烯-1-亚基]亚环丙基]-2,4-戊二酮 · CAS 63165-91-3 · C36H46O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-[2,3-双[3,5-双(1,1-二甲基乙基)-4-氧代-2,5-环己二烯-1-亚基]亚环丙基]-2,4-戊二酮