2,5-Cyclohexadien-1-one,4-(3,5-dimethoxy-4-oxo-2,5-cyclohexadien-1-ylidene)-2,6-dimethoxy
2,5-Cyclohexadien-1-one,4-(3,5-dimethoxy-4-oxo-2,5-cyclohexadien-1-ylidene)-2,6-dimethoxy structure
|
Common Name | 2,5-Cyclohexadien-1-one,4-(3,5-dimethoxy-4-oxo-2,5-cyclohexadien-1-ylidene)-2,6-dimethoxy | ||
|---|---|---|---|---|
| CAS Number | 493-74-3 | Molecular Weight | 304.29500 | |
| Density | 1.27g/cm3 | Boiling Point | 629.9ºC at 760mmHg | |
| Molecular Formula | C16H16O6 | Melting Point | 293ºC (dec.)(lit.) | |
| MSDS | USA | Flash Point | 280.6ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
| Name | coerulignone |
|---|---|
| Synonym | More Synonyms |
| Density | 1.27g/cm3 |
|---|---|
| Boiling Point | 629.9ºC at 760mmHg |
| Melting Point | 293ºC (dec.)(lit.) |
| Molecular Formula | C16H16O6 |
| Molecular Weight | 304.29500 |
| Flash Point | 280.6ºC |
| Exact Mass | 304.09500 |
| PSA | 71.06000 |
| LogP | 1.56960 |
| Vapour Pressure | 8.91E-16mmHg at 25°C |
| Index of Refraction | 1.56 |
| InChIKey | WASNBVDBYSQBPH-UHFFFAOYSA-N |
| SMILES | COC1=CC(=C2C=C(OC)C(=O)C(OC)=C2)C=C(OC)C1=O |
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | 36/37/38 |
| Safety Phrases | 26-37/39 |
| RIDADR | NONH for all modes of transport |
|
~99%
2,5-Cyclohexadi... CAS#:493-74-3 |
| Literature: Liao, Bei-Sih; Liu, Yi-Hung; Peng, Shei-Ming; Liu, Shiuh-Tzung Dalton Transactions, 2012 , vol. 41, # 4 p. 1158 - 1164 |
|
~77%
2,5-Cyclohexadi... CAS#:493-74-3
Learn More
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| Literature: Nishino, Hiroshi; Nobuyuki, Itoh; Nagashima, Makiko; Kurosawa, Kazu Bulletin of the Chemical Society of Japan, 1992 , vol. 65, # 2 p. 620 - 622 |
|
~73%
2,5-Cyclohexadi... CAS#:493-74-3
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|
| Literature: Pandey; Muralikrishna; Bhalerao Tetrahedron Letters, 1990 , vol. 31, # 26 p. 3771 - 3774 |
|
~3%
2,5-Cyclohexadi... CAS#:493-74-3
Learn More
|
| Literature: Nishino, Hiroshi; Nobuyuki, Itoh; Nagashima, Makiko; Kurosawa, Kazu Bulletin of the Chemical Society of Japan, 1992 , vol. 65, # 2 p. 620 - 622 |
|
~%
2,5-Cyclohexadi... CAS#:493-74-3
Learn More
|
| Literature: Selvaraj; Park; Kim Dalton Transactions, 2014 , vol. 43, # 3 p. 958 - 966 |
|
~%
2,5-Cyclohexadi... CAS#:493-74-3 |
| Literature: Baker,W. et al. Journal of the Chemical Society, 1964 , p. 1067 - 1072 |
| Precursor 2 | |
|---|---|
| DownStream 1 | |
|
Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
|
|
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
|
| COERULIGNONE |
| Cerulignone |
| 2,2',6,6'-tetramethoxydibenzo-1,1'-diquinone |
| 3,3',5,5'-tetramethoxydiphenoquinone |
| 4-(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-2,6-dimethoxycyclohexa-2,5-dien-1-one |
| 3,5,3',5'-tetramethoxy-4,4'-diphenoquinone |
| 3,3',5,5'-Tetramethoxy-4,4'-diphenoquinone |