Propanedinitrile,2-[(3-methoxyphenyl)methylene]
![Propanedinitrile,2-[(3-methoxyphenyl)methylene] Structure](https://image.chemsrc.com/caspic/256/2972-72-7.png)
Propanedinitrile,2-[(3-methoxyphenyl)methylene] structure
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Common Name | Propanedinitrile,2-[(3-methoxyphenyl)methylene] | ||
|---|---|---|---|---|
| CAS Number | 2972-72-7 | Molecular Weight | 184.19400 | |
| Density | 1.169g/cm3 | Boiling Point | 340.4ºC at 760mmHg | |
| Molecular Formula | C11H8N2O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 142.8ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-[(3-methoxyphenyl)methylidene]propanedinitrile |
|---|---|
| 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 | 1.169g/cm3 |
|---|---|
| Boiling Point | 340.4ºC at 760mmHg |
| Molecular Formula | C11H8N2O |
| Molecular Weight | 184.19400 |
| Flash Point | 142.8ºC |
| Exact Mass | 184.06400 |
| PSA | 56.81000 |
| LogP | 2.12576 |
| Vapour Pressure | 8.64E-05mmHg at 25°C |
| Index of Refraction | 1.589 |
| InChIKey | LZBVVVZUWLWGHM-UHFFFAOYSA-N |
| SMILES | COc1cccc(C=C(C#N)C#N)c1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~95%
Propanedinitril... CAS#:2972-72-7 |
| Literature: Li, Guowei; Xiao, Jia; Zhang, Wenqin Green Chemistry, 2011 , vol. 13, # 7 p. 1828 - 1836 |
|
~84%
Propanedinitril... CAS#:2972-72-7 |
| Literature: Shaabani, Ahmad; Rezayan, Ali Hossein; Heidary, Marjan; Sarvary, Afshin Chemical and Pharmaceutical Bulletin, 2008 , vol. 56, # 10 p. 1480 - 1482 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 4 | |
CAS#:38489-80-4
CAS#:175591-22-7
CAS#:175591-23-8
CAS#:36677-36-8This 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 MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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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.
| m-methoxybenzylidenemalonitrile |
| 2-(3-methoxyphenylmethylene)malononitrile |
| m-metoxybenzylidenemalononitrile |
| (3-methoxybenzylidene)malononitrile |
| 2-(3-methoxybenzylidene)malonitrile |
| 2-(3-Methoxybenzylidene)malononitrile |
| 3-methoxydicyanovinylbenzene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: InChIKey of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is LZBVVVZUWLWGHM-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: Related upstream materials(CAS) of 2-[(3-methoxyphenyl)methylidene]propanedinitrile: 591-31-1;109-77-3;670-54-2. |
| Q: What is the English name of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: The English name of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is 2-[(3-methoxyphenyl)methylidene]propanedinitrile. |
| Q: What is the polar surface area (PSA) of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: Polar surface area (PSA) of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is 56.81000. |
| Q: What is the Chinese name of 2972-72-7? |
| A: Chinese name of 2972-72-7 is 2972-72-7. |
| Q: What is the LogP of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: LogP of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is 2.12576. |
| Q: What are the downstream products of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: Related downstream products(CAS) of 2-[(3-methoxyphenyl)methylidene]propanedinitrile: 38489-80-4;175591-22-7;175591-23-8;36677-36-8. |
| Q: What is the SMILES notation of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: SMILES notation of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is COc1cccc(C=C(C#N)C#N)c1. |
| Q: What is the boiling point of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: Boiling point of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is 340.4ºC at 760mmHg. |
| Q: What is the molecular weight of 2-[(3-methoxyphenyl)methylidene]propanedinitrile? |
| A: Molecular weight of 2-[(3-methoxyphenyl)methylidene]propanedinitrile is 184.19400. |
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. |