[1R-(1alpha,3alpha,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate (CAS 33045-02-2) — formula C12H18O2, molecular weight 194.27; category organic chemicals.
| CAS Number | 33045-02-2 |
|---|---|
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.27 |
| LogP | 2.4 |
| Applications | Use Classification: Fragrance Ingredients, General Manufacturing Information: Bicyclo[3.1.1]heptan-3-ol, 6, 6-dimethyl-2-methylene-, 3-acetate: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, General Manufacturing Information: Bicyclo[3.1.1]heptan-3-ol, 6, 6-dimethyl-2-methylene-, 3-acetate: ACTIVE.
[1R-(1alpha,3alpha,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate is a carbon-based organic compound with CAS registry number 33045-02-2 and molecular formula C12H18O2 (molecular weight 194.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 33045-02-2
Its molecular formula C12H18O2 comprises 12 C, 18 H, 2 O atoms.
Also known as: [1R-(1alpha,3alpha,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate · [1R-(1α,3α,5α)]-6,6-二甲基-2-亚甲基双环[3.1.1]庚-3-基乙酸酯
Category: organic chemicals
The CAS registry number of [1R-(1alpha,3alpha,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate is 33045-02-2.
Molecular formula C12H18O2, molecular weight 194.27.
It is also registered under: [1R-(1alpha,3alpha,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate, [1R-(1α,3α,5α)]-6,6-二甲基-2-亚甲基双环[3.1.1]庚-3-基乙酸酯.
Recorded applications: Use Classification: Fragrance Ingredients, General Manufacturing Information: Bicyclo[3.1.1]heptan-3-ol, 6, 6-dimethyl-2-methylene-, 3-acetate: ACTIVE.
Category: Organic Chemicals.
Independent reference data for [1R-(1alpha,3alpha,5alpha)]-6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate (CAS 33045-02-2), compiled from public chemistry databases.
| CAS 号 | 33045-02-2 |
|---|---|
| PubChem CID | 102553 |
| 分子式 | C12H18O2 |
| IUPAC 名称 | (6,6-dimethyl-2-methylidene-3-bicyclo[3.1.1]heptanyl) acetate |
| UNII（FDA） | TRE9OV3CFK |
| FEMA 编号 | 4807 |
| Molecular Weight | 194.27 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 194.130679813 |
| Monoisotopic Mass | 194.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
Pinocarvyl acetate; 1078-95-1; 6,6-Dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl acetate; 2(10)-Pinen-3-ol, acetate; TRE9OV3CFK; DTXSID2051550; (6,6-dimethyl-2-methylidene-3-bicyclo[3.1.1]heptanyl) acetate; Bicyclo(3.1.1)heptan-3-ol, 6,6-dimethyl-2-methylene-, 3-acetate; 6,6-Dimethyl-2-methylenebicyclo(3.1.1)hept-3-yl acetate; Bicyclo[3.1.1]heptan-3-ol, 6,6-dimethyl-2-methylene-, 3-acetate; (6,6-dimethyl-2-methylidene-3-bicyclo(3.1.1)heptanyl) acetate; RefChem:174343; DTXCID6030102; FEMA NO. 4807; 214-085-9; cis-Pinocarvyl acetate
| GHS 通报统计 | 100% (89 / 89) |
|---|
| GHS 通报统计 | 100% (89 / 89) |
|---|
[1R-(1α,3α,5α)]-6,6-二甲基-2-亚甲基双环[3.1.1]庚-3-基乙酸酯 · CAS 33045-02-2 · C12H18O2. UNII TRE9OV3CFK.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.