脱氢二氢母紫罗兰醇(CAS 57069-86-0):分子式 C13H22O、分子量 194.31。
| CAS号 | 57069-86-0 |
|---|---|
| 分子式 | C13H22O |
| 分子量 | 194.31 |
| 沸点 | 80.00 °C. @ 1.00 mm Hg |
| LogP | 2.9 |
脱氢二氢母紫罗兰醇 是一种化工化合物,登记 CAS 号为 57069-86-0,分子式 C13H22O(分子量 194.31)。
登记 CAS 号:57069-86-0
其分子式 C13H22O 由 13 个碳、22 个氢、1 个氧 组成。
别名/同义词:脱氢二氢母紫罗兰醇 · Dehydrodihydroionol
脱氢二氢母紫罗兰醇 的 CAS 登记号为 57069-86-0。
分子式 C13H22O,分子量 194.31。
别名/同义词:脱氢二氢母紫罗兰醇、Dehydrodihydroionol。
脱氢二氢母紫罗兰醇(CAS 57069-86-0)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 57069-86-0 |
|---|---|
| PubChem CID | 62126 |
| Molecular formula | C13H22O |
| Molecular weight | 194.17 g/mol |
| IUPAC name | 4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-ol |
| InChIKey | WPGXAVCJKGSOBD-UHFFFAOYSA-N |
| UNII (FDA) | VQS2EA7ID5 |
| ChEBI ID | CHEBI:192162 |
| FEMA number | 3446 |
| JECFA number | 397 |
| Molecular Weight | 194.31 |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 3 |
| Exact Mass | 194.167065321 |
| Monoisotopic Mass | 194.167065321 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 14 |
| Boiling Point | 80.00 °C. @ 1.00 mm Hg |
|---|---|
| Boiling Point | 80 °C (1 mm Hg) |
| Density | 0.918-0.926 |
| Refractive Index | 1.489-1.496 |
Dehydrodihydroionol; 57069-86-0; FEMA No. 3446; VQS2EA7ID5; 1,3-Cyclohexadiene-1-propanol, .alpha.,2,6,6-tetramethyl-; alpha,2,6,6-Tetramethyl-1,3-cyclohexadiene-1-propanol; DEHYDRODIHYDROIONOL [FHFI]; DEHYDRODIHYDROIONOL, (+/)-; 1,3-Cyclohexadiene-1-propanol, alpha,2,6,6-tetramethyl-; 7,8-DIHYDRO-3,4-DEHYDRO-BETA-IONOL; 7,8-DIHYDRO-3,4-DEHYDRO-.BETA.-IONOL; .ALPHA.,2,6,6-TETRAMETHYL-1,3-CYCLOHEXADIENE-1-PROPANOL; 4-(2,6,6-TRIMETHYL-1,3-CYCLOHEXADIEN-1-YL)-2-BUTANOL; RefChem:585635; (+-)-DEHYDRODIHYDROIONOL; 611-458-1
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent |
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Dehydrodihydroionol is identified by CAS 57069-86-0, molecular formula C13H22O and molecular weight 194.17 g/mol. UNII VQS2EA7ID5; ChEBI 192162; InChIKey WPGXAVCJKGSOBD-UHFFFAOYSA-N. Boiling Point: 80.00 °C. @ 1.00 mm Hg; Boiling Point: 80 °C (1 mm Hg); Density: 0.918-0.926.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: Dehydrodihydroionol