ethyl undecanoate (CAS 627-90-7) — formula C13H26O2, molecular weight 214.19 g/mol; category organic chemicals.
| CAS Number | 627-90-7 |
|---|---|
| Molecular Formula | C13H26O2 |
| Molecular Weight | 214.19 g/mol |
| Melting Point | -15 °C |
| Boiling Point | 105.00 °C. @ 4.00 mm Hg |
| LogP | 5.1 |
| Category | Organic Chemicals |
ethyl undecanoate is a carbon-based organic compound with CAS registry number 627-90-7 and molecular formula C13H26O2 (molecular weight 214.19 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 627-90-7
Its molecular formula C13H26O2 comprises 13 C, 26 H, 2 O atoms.
Also known as: ethyl undecanoate · 十一烷酸乙酯
Category: organic chemicals
The CAS registry number of ethyl undecanoate is 627-90-7.
Molecular formula C13H26O2, molecular weight 214.19 g/mol.
It is also registered under: ethyl undecanoate, 十一烷酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl undecanoate (CAS 627-90-7), compiled from public chemistry databases.
| CAS Registry Number | 627-90-7 |
|---|---|
| PubChem CID | 12327 |
| Molecular formula | C13H26O2 |
| Molecular weight | 214.19 g/mol |
| IUPAC name | ethyl undecanoate |
| InChIKey | IAFQYUQIAOWKSB-UHFFFAOYSA-N |
| UNII (FDA) | Q5223I1993 |
| ChEBI ID | CHEBI:180101 |
| FEMA number | 3492 |
| JECFA number | 36 |
| Molecular Weight | 214.34 |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 11 |
| Exact Mass | 214.193280068 |
| Monoisotopic Mass | 214.193280068 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
| Boiling Point | 105.00 °C. @ 4.00 mm Hg |
|---|---|
| Boiling Point | 255 °C |
| Melting Point | -15 °C |
| Density | 0.87 |
| Refractive Index | 1.438 |
ETHYL UNDECANOATE; Undecanoic acid, ethyl ester; Undecanoic acid ethyl ester; Ethyl undecylate; Ethyl hendecanoate; Ethyl n-undecanoate; n-Undecanoic acid ethyl ester; FEMA No. 3492; UNII-Q5223I1993; EINECS 211-018-5; NSC-97265; ETHYL UNDECANOATE [FHFI]; AI3-04250; FEMA 3492; Q5223I1993; HENDECANOIC ACID, ETHYL ESTER
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Coconut, Cognac No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (136 / 136) |
| GHS notification summary | 100% (136 / 136) |
|---|
This chemical does not meet GHS hazard criteria for 100% (136 of 136) of all reports.
Reported as not meeting GHS hazard criteria by 136 of 136 companies. For more detailed information, please visit ECHA C&L website.
ethyl undecanoate is identified by CAS 627-90-7, molecular formula C13H26O2 and molecular weight 214.19 g/mol. UNII Q5223I1993; ChEBI 180101; InChIKey IAFQYUQIAOWKSB-UHFFFAOYSA-N. Boiling Point: 105.00 °C. @ 4.00 mm Hg; Boiling Point: 255 °C; Melting Point: -15 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 十一烷酸乙酯