C3 HEXENYL T2 HEXENOATE (CAS 53398-87-1) — formula C12H20O2, molecular weight 196.29; category organic chemicals.
| CAS Number | 53398-87-1 |
|---|---|
| Molecular Formula | C12H20O2 |
| Molecular Weight | 196.29 |
| Boiling Point | 114.00 to 115.00 °C. @ 15.00 mm Hg |
| LogP | 3.7 |
| Applications | Use Classification: Flavoring Agents -> JECFA Flavorings Index |
| Category | Organic Chemicals |
Documented applications: Use Classification: Flavoring Agents -> JECFA Flavorings Index.
C3 HEXENYL T2 HEXENOATE is a carbon-based organic compound with CAS registry number 53398-87-1 and molecular formula C12H20O2 (molecular weight 196.29), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53398-87-1
Its molecular formula C12H20O2 comprises 12 C, 20 H, 2 O atoms.
Also known as: C3 HEXENYL T2 HEXENOATE · (E,Z)-2-己烯酸-3-己烯酯
Category: organic chemicals
The CAS registry number of C3 HEXENYL T2 HEXENOATE is 53398-87-1.
Molecular formula C12H20O2, molecular weight 196.29.
It is also registered under: C3 HEXENYL T2 HEXENOATE, (E,Z)-2-己烯酸-3-己烯酯.
Recorded applications: Use Classification: Flavoring Agents -> JECFA Flavorings Index.
Category: Organic Chemicals.
Independent reference data for C3 HEXENYL T2 HEXENOATE (CAS 53398-87-1), compiled from public chemistry databases.
| CAS 号 | 53398-87-1 |
|---|---|
| PubChem CID | 5367679 |
| 分子式 | C12H20O2 |
| IUPAC 名称 | [(Z)-hex-3-enyl] (E)-hex-2-enoate |
| UNII（FDA） | S3878T105H |
| FEMA 编号 | 3928 |
| JECFA 编号 | 1279 |
| Molecular Weight | 196.29 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 196.146329876 |
| Monoisotopic Mass | 196.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
| Boiling Point | 114.00 to 115.00 °C. @ 15.00 mm Hg |
|---|---|
| Boiling Point | 114-115 °C (15 mm Hg) |
| Density | 0.897-0.905 |
| Refractive Index | 1.453-1.461 |
cis-3-Hexenyl trans-2-hexenoate; 53398-87-1; 2-Hexenoic acid, 3-hexenyl ester, (E,Z)-; 3-Hexenyl 2-hexenoate, (3Z,2E)-; FEMA No. 3928; (3Z)-hex-3-en-1-yl (2E)-hex-2-enoate; 2-Hexenoic acid, (3Z)-3-hexenyl ester, (2E)-; (Z)-3-hexenyl (E)-2-hexenoate; S3878T105H; 2-Hexenoic acid, (3Z)-3-hexen-1-yl ester, (2E)-; (Z)-3-Hexenyl (E)-2-hexenoate [FIFH]; DTXSID001018195; 3-HEXENYL TRANS-2-HEXENOATE, CIS-; (Z)-3-HEXENYL (E)-2-HEXENOATE [FHFI]; (Z)-3-Hexenyl (E)-2-hexenoate (FIFH); RefChem:502191
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents Fruit |
|---|
(E,Z)-2-己烯酸-3-己烯酯 · CAS 53398-87-1 · C12H20O2. UNII S3878T105H. Boiling Point: 114.00 to 115.00 °C. @ 15.00 mm Hg; Boiling Point: 114-115 °C (15 mm Hg); Density: 0.897-0.905.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (E,Z)-2-己烯酸-3-己烯酯