Caffeic acid phenethyl ester (CAS 104594-70-9) — formula C17H16O4, molecular weight 284.31; category organic chemicals.
| CAS Number | 104594-70-9 |
|---|---|
| Molecular Formula | C17H16O4 |
| Molecular Weight | 284.31 |
| LogP | 4.2 |
| Category | Organic Chemicals |
Caffeic acid phenethyl ester is a carbon-based organic compound with CAS registry number 104594-70-9 and molecular formula C17H16O4 (molecular weight 284.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 104594-70-9
Its molecular formula C17H16O4 comprises 17 C, 16 H, 4 O atoms.
Also known as: Caffeic acid phenethyl ester · 咖啡酸苯乙酯
Category: organic chemicals
The CAS registry number of Caffeic acid phenethyl ester is 104594-70-9.
Molecular formula C17H16O4, molecular weight 284.31.
It is also registered under: Caffeic acid phenethyl ester, 咖啡酸苯乙酯.
Category: Organic Chemicals.
Independent reference data for Caffeic acid phenethyl ester (CAS 104594-70-9), compiled from public chemistry databases.
| CAS Registry Number | 104594-70-9 |
|---|---|
| PubChem CID | 108042 |
| Molecular formula | C17H16O4 |
| IUPAC name | 2-phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate |
| UNII (FDA) | HMS3269P17 |
| Molecular Weight | 284.31 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 284.10485899 |
| Monoisotopic Mass | 284.10485899 |
| Topological Polar Surface Area | 66.8 |
| Heavy Atom Count | 21 |
Caffeic acid-phenethyl ester; 2-phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate; RefChem:1080633; 3,4-Dihydroxycinnamic Acid Phenethyl Ester; phenethyl 3,4-dihydroxycinnamate; Spectrum2_000819; Spectrum3_001986; SCHEMBL93649; KBioGR_000280; KBioSS_000280; 3-(3,4-Dihydroxyphenyl)-2-propenoic acid 2-phenylethyl ester; SPBio_000717; Caffeic acid 2-phenylethyl ester; KBio2_000280; KBio2_002848; KBio2_005416
Caffeic acid phenethyl ester · CAS 104594-70-9 · C17H16O4. UNII HMS3269P17.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 咖啡酸苯乙酯