methyl 7-chloro-3-oxoheptanoate
methyl 7-chloro-3-oxoheptanoate structure
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Common Name | methyl 7-chloro-3-oxoheptanoate | ||
|---|---|---|---|---|
| CAS Number | 22977-45-3 | Molecular Weight | 192.64000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C8H13ClO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: Methyl 7-chloro-3-oxoheptanoate, Chinese name: 甲基庚内酰氯, CAS number: 22977-45-3, molecular formula: C8H13ClO3, molecular weight: 192.64. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl 7-chloro-3-oxoheptanoate |
|---|---|
| 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.
| Molecular Formula | C8H13ClO3 |
|---|---|
| Molecular Weight | 192.64000 |
| Exact Mass | 192.05500 |
| PSA | 43.37000 |
| LogP | 1.52770 |
| InChIKey | QHKVMRWBNYGDEH-UHFFFAOYSA-N |
| SMILES | COC(=O)CC(=O)CCCCCl |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~77%
methyl 7-chloro... CAS#:22977-45-3 |
| Literature: Langer, Peter; Bellur, Esen Journal of Organic Chemistry, 2003 , vol. 68, # 25 p. 9742 - 9746 |
|
~85%
methyl 7-chloro... CAS#:22977-45-3 |
| Literature: Hannick; Kishi Journal of Organic Chemistry, 1983 , vol. 48, # 21 p. 3833 - 3835 |
|
~72%
methyl 7-chloro... CAS#:22977-45-3 |
| Literature: Calvet, Sandrine; David, Olivier; Vanucci-Bacque, Corinne; Fargeau-Bellassoued, Marie-Claude; Lhommet, Gerard Tetrahedron, 2003 , vol. 59, # 33 p. 6333 - 6339 |
|
~%
methyl 7-chloro... CAS#:22977-45-3 |
| Literature: Hannick; Kishi Journal of Organic Chemistry, 1983 , vol. 48, # 21 p. 3833 - 3835 |
|
~%
methyl 7-chloro... CAS#:22977-45-3 |
| Literature: Hashimoto, Norio; Funatomi, Takashi; Misaki, Tomonori; Tanabe, Yoo Tetrahedron, 2006 , vol. 62, # 10 p. 2214 - 2223 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 4 | |
CAS#:41302-34-5
CAS#:131134-77-5
CAS#:171866-64-1
CAS#:86971-64-4This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 7-Chlor-3-oxo-heptansaeure-methylester |
| Heptanoic acid,7-chloro-3-oxo-,methyl ester |
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 methyl 7-chloro-3-oxoheptanoate? |
| A: Molecular weight of methyl 7-chloro-3-oxoheptanoate is 192.64000. |
| Q: What is the InChIKey of methyl 7-chloro-3-oxoheptanoate? |
| A: InChIKey of methyl 7-chloro-3-oxoheptanoate is QHKVMRWBNYGDEH-UHFFFAOYSA-N. |
| Q: What are the downstream products of methyl 7-chloro-3-oxoheptanoate? |
| A: Related downstream products(CAS) of methyl 7-chloro-3-oxoheptanoate: 41302-34-5;131134-77-5;171866-64-1;86971-64-4. |
| Q: What is the LogP of methyl 7-chloro-3-oxoheptanoate? |
| A: LogP of methyl 7-chloro-3-oxoheptanoate is 1.52770. |
| Q: What is the polar surface area (PSA) of methyl 7-chloro-3-oxoheptanoate? |
| A: Polar surface area (PSA) of methyl 7-chloro-3-oxoheptanoate is 43.37000. |
| Q: What is the English name of methyl 7-chloro-3-oxoheptanoate? |
| A: The English name of methyl 7-chloro-3-oxoheptanoate is methyl 7-chloro-3-oxoheptanoate. |
| Q: What is the SMILES notation of methyl 7-chloro-3-oxoheptanoate? |
| A: SMILES notation of methyl 7-chloro-3-oxoheptanoate is COC(=O)CC(=O)CCCCCl. |
| Q: What is the molecular formula of methyl 7-chloro-3-oxoheptanoate? |
| A: Molecular formula of methyl 7-chloro-3-oxoheptanoate is C8H13ClO3. |
| Q: What is the CAS number of methyl 7-chloro-3-oxoheptanoate? |
| A: CAS number of methyl 7-chloro-3-oxoheptanoate is 22977-45-3. |
| Q: What is the Chinese name of 22977-45-3? |
| A: Chinese name of 22977-45-3 is 22977-45-3. |