(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯(CAS 80657-64-3):分子式 C13H20O2、分子量 208.30。
| CAS号 | 80657-64-3 |
|---|---|
| 分子式 | C13H20O2 |
| 分子量 | 208.30 |
| LogP | 3.4 |
| 应用领域 | Use Classification: Fragrance Ingredients、Household Products: Information on 4 consumer products that contain Ethyl hexahydro-4、7-methanoindane-3a-carboxylate in the following categories is provided:、• Auto Products、• Inside the Home |
登记用途:Use Classification: Fragrance Ingredients、Household Products: Information on 4 consumer products that contain Ethyl hexahydro-4、7-methanoindane-3a-carboxylate in the following categories is provided:、• Auto Products、• Inside the Home。
(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯 是一种化工化合物,登记 CAS 号为 80657-64-3,分子式 C13H20O2(分子量 208.30)。
登记 CAS 号:80657-64-3
其分子式 C13H20O2 由 13 个碳、20 个氢、2 个氧 组成。
别名/同义词:(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯 · A mixture of: ethyl exo-tricyclo[5.2.1.0-{2,6}-]decane-endo-2-carboxylate and ethyl-endo-tricyclo[5.2.1.0-{2,6}-]decane-exo-2-carboxylate
(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯 的 CAS 登记号为 80657-64-3。
分子式 C13H20O2,分子量 208.30。
别名/同义词:(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯、A mixture of: ethyl exo-tricyclo[5.2.1.0-{2,6}-]decane-endo-2-carboxylate and ethyl-endo-tricyclo[5.2.1.0-{2,6}-]decane-exo-2-carboxylate。
登记用途:Use Classification: Fragrance Ingredients、Household Products: Information on 4 consumer products that contain Ethyl hexahydro-4、7-methanoindane-3a-carboxylate in the following categories is provided:、• Auto Products、• Inside the Home。
(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯(CAS 80657-64-3)的独立参考数据,整理自公开化学数据库。
| CAS 号 | 80657-64-3 |
|---|---|
| PubChem CID | 157343 |
| 分子式 | C13H20O2 |
| IUPAC 名称 | ethyl (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decane-2-carboxylate |
| UNII(FDA) | NS00123436 |
| Molecular Weight | 208.30 |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 208.146329876 |
| Monoisotopic Mass | 208.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
Ethyl hexahydro-4,7-methanoindane-3a-carboxylate; EC 407-520-0; 4,7-Methano-3aH-indene-3a-carboxylic acid, octahydro-, ethyl ester, (3aR,4S,7R,7aR)-rel-; 4,7-Methano-3aH-indene-3a-carboxylic acid, octahydro-, ethyl ester, (3aalpha,4alpha,7alpha,7aalpha)-; RefChem:508335; 4,7-Methano-3aH-indene-3a-carboxylic acid, octahydro-, ethyl ester, (3a.alpha.,4.alpha.,7.alpha.,7a.alpha.)-; 687-614-8; 80657-64-3; ethyl (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decane-2-carboxylate; SCHEMBL1773391; DTXSID4052552; MGQPKOBPXHENPO-LSCVPOLPSA-N; NS00123436; ethyl (3aR,4S,7R,7aR)-octahydro-3aH-4,7-methanoindene-3a-carboxylate; Ethyl (3aR,4S,7R,7aR)-octahydro-3aH-4,7-methanoindene-3a-carboxylate rel; 4,7-Methano-3aH-indene-3a-carboxylic acid, octahydro-, ethyl ester, (3aR,4S,7R,7aR)-
| 已通报的危害声明 | H315, H411 |
|---|
(3AΑ,4Α,7Α,7AΑ)-八氢-4,7-亚甲基-3AH-茚-3A-甲酸乙酯 · CAS 80657-64-3 · C13H20O2. UNII NS00123436.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。