3-(2-benzothiazol-2-yl-2-cyano-ethenyl)-1-prop-2-enyl-thiourea
3-(2-benzothiazol-2-yl-2-cyano-ethenyl)-1-prop-2-enyl-thiourea structure
|
Common Name | 3-(2-benzothiazol-2-yl-2-cyano-ethenyl)-1-prop-2-enyl-thiourea | ||
|---|---|---|---|---|
| CAS Number | 4927-55-3 | Molecular Weight | 316.34800 | |
| Density | 1.319g/cm3 | Boiling Point | 437.4ºC at 760 mmHg | |
| Molecular Formula | C18H20O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 218.3ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1,2-bis(3,4-dimethoxyphenyl)-Ethanone |
|---|---|
| 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 | 1.319g/cm3 |
|---|---|
| Boiling Point | 437.4ºC at 760 mmHg |
| Molecular Formula | C18H20O5 |
| Molecular Weight | 316.34800 |
| Flash Point | 218.3ºC |
| Exact Mass | 316.13100 |
| PSA | 53.99000 |
| LogP | 3.14640 |
| Index of Refraction | 1.697 |
| InChIKey | IBOFMJSGASGBOS-UHFFFAOYSA-N |
| SMILES | COc1ccc(CC(=O)c2ccc(OC)c(OC)c2)cc1OC |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~71%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Churruca, Fatima; SanMartin, Raul; Carril, Monica; Tellitu, Imanol; Dominguez, Esther Tetrahedron, 2004 , vol. 60, # 10 p. 2393 - 2408 |
|
~84%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Elliott, I. Wesley; Sloan, Milton J.; Tate, Earl Tetrahedron, 1996 , vol. 52, # 24 p. 8063 - 8072 |
|
~84%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Badia, D.; Dominguez, E.; Galarza, J.; Lete, E.; Marigorta, E. Martinez de; Villa, M. J. Bulletin des Societes Chimiques Belges, 1989 , vol. 98, # 1 p. 77 - 82 |
|
~67%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Badia, D.; Dominguez, E.; Galarza, J.; Lete, E.; Marigorta, E. Martinez de; Villa, M. J. Bulletin des Societes Chimiques Belges, 1989 , vol. 98, # 1 p. 77 - 82 |
|
~%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Allen; Buck Journal of the American Chemical Society, 1930 , vol. 52, p. 310,312 |
|
~%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Badia, D.; Dominguez, E.; Galarza, J.; Lete, E.; Marigorta, E. Martinez de; Villa, M. J. Bulletin des Societes Chimiques Belges, 1989 , vol. 98, # 1 p. 77 - 82 |
|
~%
3-(2-benzothiaz... CAS#:4927-55-3
Learn More
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| Literature: Fritsch Justus Liebigs Annalen der Chemie, 1903 , vol. 329, p. 51 Anm. |
|
~95%
3-(2-benzothiaz... CAS#:4927-55-3 |
| Literature: Makhey, Darshan; Gatto, Barbara; Yu, Chiang; Liu, Angela; Liu, Leroy F.; LaVoie, Edmond J. Bioorganic and Medicinal Chemistry, 1996 , vol. 4, # 6 p. 781 - 791 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
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CAS#:5471-40-9This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1,3-bis (3,4-dimethoxyphenyl)prop-2-en-1-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: InChIKey of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is IBOFMJSGASGBOS-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: Molecular weight of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is 316.34800. |
| Q: What English synonyms does 1,2-bis(3,4-dimethoxyphenyl)-Ethanone have? |
| A: English synonyms of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone: 1,3-bis (3,4-dimethoxyphenyl)prop-2-en-1-one. |
| Q: What is the English name of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: The English name of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is 1,2-bis(3,4-dimethoxyphenyl)-Ethanone. |
| Q: What is the molecular formula of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: Molecular formula of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is C18H20O5. |
| Q: What is the LogP of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: LogP of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is 3.14640. |
| Q: What are the upstream materials of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: Related upstream materials(CAS) of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone: 91-16-7;10313-60-7;2859-78-1;1131-62-0;93-40-3;37672-97-2;7306-46-9;37673-01-1;554-34-7;120-14-9. |
| Q: What is the polar surface area (PSA) of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: Polar surface area (PSA) of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is 53.99000. |
| Q: What is the CAS number of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: CAS number of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is 4927-55-3. |
| Q: What is the SMILES notation of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone? |
| A: SMILES notation of 1,2-bis(3,4-dimethoxyphenyl)-Ethanone is COc1ccc(CC(=O)c2ccc(OC)c(OC)c2)cc1OC. |
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. |