dimethyl 2-phenylsulfanylhexanedioate
dimethyl 2-phenylsulfanylhexanedioate structure
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Common Name | dimethyl 2-phenylsulfanylhexanedioate | ||
|---|---|---|---|---|
| CAS Number | 5331-03-3 | Molecular Weight | 282.35500 | |
| Density | 1.16g/cm3 | Boiling Point | 369.5ºC at 760 mmHg | |
| Molecular Formula | C14H18O4S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 169.5ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | dimethyl 2-phenylsulfanylhexanedioate |
|---|---|
| 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 | 1.16g/cm3 |
|---|---|
| Boiling Point | 369.5ºC at 760 mmHg |
| Molecular Formula | C14H18O4S |
| Molecular Weight | 282.35500 |
| Flash Point | 169.5ºC |
| Exact Mass | 282.09300 |
| PSA | 77.90000 |
| LogP | 2.66360 |
| Index of Refraction | 1.534 |
| InChIKey | OJRYTGNJDCKLLN-UHFFFAOYSA-N |
| SMILES | COC(=O)CCCC(Sc1ccccc1)C(=O)OC |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2930909090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~%
dimethyl 2-phen... CAS#:5331-03-3 |
| Literature: Hurd; Gershbein Journal of the American Chemical Society, 1947 , vol. 69, p. 2328,2330 |
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~%
dimethyl 2-phen... CAS#:5331-03-3 |
| Literature: de Groot,A.; Jansen,B.J.M. Recueil des Travaux Chimiques des Pays-Bas, 1979 , vol. 98, p. 487 - 492 |
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~%
dimethyl 2-phen... CAS#:5331-03-3 |
| Literature: de Groot,A.; Jansen,B.J.M. Recueil des Travaux Chimiques des Pays-Bas, 1979 , vol. 98, p. 487 - 492 |
|
~%
dimethyl 2-phen... CAS#:5331-03-3 |
| Literature: de Groot,A.; Jansen,B.J.M. Recueil des Travaux Chimiques des Pays-Bas, 1979 , vol. 98, p. 487 - 492 |
|
~%
Detail
Learn More
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| Literature: Crawhall; Elliott Journal of the Chemical Society, 1952 , p. 3094,3098, 3102 Full Text Show Details Niederl; Hart Journal of the American Chemical Society, 1942 , vol. 64, p. 2487 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Di-methyl-2-phenylthio-hexan-dioat |
| 2-phenylsulfanyl-adipic acid dimethyl ester |
| 2-Phenylmercapto-adipinsaeure-dimethylester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of dimethyl 2-phenylsulfanylhexanedioate? |
| A: Molecular weight of dimethyl 2-phenylsulfanylhexanedioate is 282.35500. |
| Q: What is the molecular formula of dimethyl 2-phenylsulfanylhexanedioate? |
| A: Molecular formula of dimethyl 2-phenylsulfanylhexanedioate is C14H18O4S. |
| Q: What is the LogP of dimethyl 2-phenylsulfanylhexanedioate? |
| A: LogP of dimethyl 2-phenylsulfanylhexanedioate is 2.66360. |
| Q: What is the SMILES notation of dimethyl 2-phenylsulfanylhexanedioate? |
| A: SMILES notation of dimethyl 2-phenylsulfanylhexanedioate is COC(=O)CCCC(Sc1ccccc1)C(=O)OC. |
| Q: What is the CAS number of dimethyl 2-phenylsulfanylhexanedioate? |
| A: CAS number of dimethyl 2-phenylsulfanylhexanedioate is 5331-03-3. |
| Q: What is the boiling point of dimethyl 2-phenylsulfanylhexanedioate? |
| A: Boiling point of dimethyl 2-phenylsulfanylhexanedioate is 369.5ºC at 760 mmHg. |
| Q: What is the InChIKey of dimethyl 2-phenylsulfanylhexanedioate? |
| A: InChIKey of dimethyl 2-phenylsulfanylhexanedioate is OJRYTGNJDCKLLN-UHFFFAOYSA-N. |
| Q: What is the Chinese name of 5331-03-3? |
| A: Chinese name of 5331-03-3 is 5331-03-3. |
| Q: What is the polar surface area (PSA) of dimethyl 2-phenylsulfanylhexanedioate? |
| A: Polar surface area (PSA) of dimethyl 2-phenylsulfanylhexanedioate is 77.90000. |
| Q: What English synonyms does dimethyl 2-phenylsulfanylhexanedioate have? |
| A: English synonyms of dimethyl 2-phenylsulfanylhexanedioate: Di-methyl-2-phenylthio-hexan-dioat, 2-phenylsulfanyl-adipic acid dimethyl ester, 2-Phenylmercapto-adipinsaeure-dimethylester. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |