CAS Number100981-80-4
SynonymsPhenylethyl caffeate; Phenethyl caffeate; 2-Phenyethyl caffeate; 2-Phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate; CAPE; Caffeic Acid Phenethyl Este; phenethyl-3,4-dihydroxybenzoate; N-phenethyl-7H-purin-6-amine; 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate; Caffeic acid phenethyl ester; Caffeic acid 2-phenylethyl ester; Caffeic Acid phenylethyl ester; 2-Phenylethyl caffeate; 2-Phenylethyl caffeoate
Molecular FormulaC15H14O4
Molecular Weight284.31
Purity≥97 (HPLC)%
Density1.3±0.1 g/cm3
Boiling Point498.6±45.0 °C at 760 mmHg
Appearancepowder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 100981-80-4 |
| Catalog No. | 2A-9009534 |
| Chinese Name | 咖啡酸苯乙酯 |
| Synonyms | Phenylethyl caffeate; Phenethyl caffeate; 2-Phenyethyl caffeate; 2-Phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate; CAPE; Caffeic Acid Phenethyl Este; phenethyl-3,4-dihydroxybenzoate; N-phenethyl-7H-purin-6-amine; 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate; Caffeic acid phenethyl ester; Caffeic acid 2-phenylethyl ester; Caffeic Acid phenylethyl ester; 2-Phenylethyl caffeate; 2-Phenylethyl caffeoate |
| Molecular Formula | C15H14O4 |
| Molecular Weight | 284.31 |
| Purity | ≥97 (HPLC) |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 498.6±45.0 °C at 760 mmHg |
| Appearance | powder |
| PubChem ID | 24278341 |
| MDL Number | MFCD00866470 |
| SMILES | Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O |
| InChI | 1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+ |
| InChI Key | SWUARLUWKZWEBQ-VQHVLOKHSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352108 |
| MSDS | msds/9534_1_100981_80_4.pdf |
| Transport Info | Product name: Caffeic acid phenethyl ester |
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