3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE (CAS 141-16-2) — formula C14H26O2, molecular weight 226.35; category organic chemicals.
3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE is a carbon-based organic compound with CAS registry number 141-16-2 and molecular formula C14H26O2 (molecular weight 226.35), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 141-16-2
Its molecular formula C14H26O2 comprises 14 C, 26 H, 2 O atoms.
Also known as: 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE · citronellyl butyrate
Category: organic chemicals
The CAS registry number of 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE is 141-16-2.
Molecular formula C14H26O2, molecular weight 226.35.
It is also registered under: 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE, citronellyl butyrate.
Category: Organic Chemicals.
Public-database records for 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE (CAS 141-16-2), reproduced here for independent cross-checking.
| GHS notification summary | 95.7% (1598 / 1669) |
|---|
This chemical does not meet GHS hazard criteria for 95.7% (1598 of 1669) of all reports.
Reported as not meeting GHS hazard criteria by 1598 of 1669 companies (only 4.3% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit, Rose No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 95.7% (1598 / 1669) |
| 沸点 | 245.00 °C. @ 760.00 mm Hg |
|---|---|
| 沸点 | 245 °C |
| 密度 | 0.873-0.883 |
| 折射率 | 1.444-1.448 |
| CAS Registry Number | 141-16-2 |
|---|---|
| PubChem CID | 8835 |
| 分子式 | C14H26O2 |
| IUPAC 名称 | 3,7-dimethyloct-6-enyl butanoate |
| UNII（FDA） | IY68QPD54V |
| FEMA 编号 | 2312 |
| JECFA 编号 | 65 |
Citronellyl butyrate; 141-16-2; 3,7-dimethyloct-6-en-1-yl butanoate; Butanoic acid, 3,7-dimethyl-6-octen-1-yl ester; Butanoic acid, 3,7-dimethyl-6-octenyl ester; FEMA No. 2312; 3,7-Dimethyl-6-octen-1-yl butyrate; Butyric acid, 3,7-dimethyl-6-octenyl ester; (1)-3,7-Dimethyloct-6-enyl butyrate; DTXSID5047405; 6-OCTEN-1-OL, 3,7-DIMETHYL-, BUTYRATE; IY68QPD54V; NSC-46147; DTXCID3027405; RefChem:577481; 205-463-4
| 分子量 | 226.35 |
|---|---|
| XLogP3 | 4.6 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 9 |
| 精确质量 | 226.193280068 |
| 单同位素质量 | 226.193280068 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 16 |
| 形式电荷 | 0 |
3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE · CAS 141-16-2 · C14H26O2. UNII IY68QPD54V. 沸点: 245.00 °C. @ 760.00 mm Hg; 沸点: 245 °C; 密度: 0.873-0.883.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.