phenethyl phenylacetate (CAS 102-20-5) — formula C16H16O2, molecular weight 240.12 g/mol; category organic chemicals.
| CAS Number | 102-20-5 |
|---|---|
| Molecular Formula | C16H16O2 |
| Molecular Weight | 240.12 g/mol |
| Melting Point | 28 °C |
| Boiling Point | 324.00 to 325.00 °C. @ 760.00 mm Hg |
| LogP | 3.9 |
| Applications | Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Fragrance, Fixing agent (mordant), Consumer Uses: Fragrance, Household Products: Information on 17 consumer products that contain Phenethyl Phenylacetate in the following categories is provided:, • Inside the Home, U.S. Production: 2023: 20, 983 lb, 2022: 438, 574 lb, 2021: 79, 709 lb, 2020: 34, 105 lb, General Manufacturing Information: All Other Chemical Product and Preparation Manufacturing, Benzeneacetic acid, 2-phenylethyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Fragrance, Fixing agent (mordant), Consumer Uses: Fragrance, Household Products: Information on 17 consumer products that contain Phenethyl Phenylacetate in the following categories is provided:, • Inside the Home, U.S. Production: 2023: 20, 983 lb, 2022: 438, 574 lb, 2021: 79, 709 lb, 2020: 34, 105 lb, General Manufacturing Information: All Other Chemical Product and Preparation Manufacturing, Benzeneacetic acid, 2-phenylethyl ester: ACTIVE.
phenethyl phenylacetate is a carbon-based organic compound with CAS registry number 102-20-5 and molecular formula C16H16O2 (molecular weight 240.12 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 102-20-5
Its molecular formula C16H16O2 comprises 16 C, 16 H, 2 O atoms.
Also known as: phenethyl phenylacetate · Phenyl Ethyl Phenyl Acetate
Category: organic chemicals
The CAS registry number of phenethyl phenylacetate is 102-20-5.
Molecular formula C16H16O2, molecular weight 240.12 g/mol.
It is also registered under: phenethyl phenylacetate, Phenyl Ethyl Phenyl Acetate.
Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Industry Uses: Fragrance, Fixing agent (mordant), Consumer Uses: Fragrance, Household Products: Information on 17 consumer products that contain Phenethyl Phenylacetate in the following categories is provided:, • Inside the Home, U.S. Production: 2023: 20, 983 lb, 2022: 438, 574 lb, 2021: 79, 709 lb, 2020: 34, 105 lb, General Manufacturing Information: All Other Chemical Product and Preparation Manufacturing, Benzeneacetic acid, 2-phenylethyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for phenethyl phenylacetate (CAS 102-20-5), compiled from public chemistry databases.
| CAS Registry Number | 102-20-5 |
|---|---|
| PubChem CID | 7601 |
| Molecular formula | C16H16O2 |
| Molecular weight | 240.12 g/mol |
| IUPAC name | 2-phenylethyl 2-phenylacetate |
| InChIKey | ZOZIRNMDEZKZHM-UHFFFAOYSA-N |
| UNII (FDA) | 5J5OJ7GH15 |
| ChEBI ID | CHEBI:173735 |
| FEMA number | 2866 |
| JECFA number | 999 |
| Molecular Weight | 240.30 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 240.115029749 |
| Monoisotopic Mass | 240.115029749 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 18 |
| Boiling Point | 324.00 to 325.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 325 °C |
| Melting Point | 28 °C |
| Density | 1.079-1.082 |
| Refractive Index | 1.545-1.551 |
Phenethyl phenylacetate; 2-Phenylethyl phenylacetate; Benzeneacetic acid, 2-phenylethyl ester; 2-phenylethyl 2-phenylacetate; Phenylethyl phenylacetate; Phenylacetic acid, phenethyl ester; ACETIC ACID, PHENYL-, PHENETHYL ESTER; Benzylcarbinyl alpha-toluate; Phenethyl alpha-toluate; Benzylcarbinyl phenylacetate; 2-Phenylethyl alpha-toluate; 2-Phenylethyl benzeneacetate; FEMA No. 2866; NSC 6676; AI3-20106; .beta.-Phenylethyl phenylacetate
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 1.1% (21 / 1880) |
| GHS notification summary | 1.1% (21 / 1880) |
|---|---|
| Reported hazard statements | H411 (96.8%) |
This chemical does not meet GHS hazard criteria for 1.1% (21 of 1880) of reports.
H411 (96.8%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
phenethyl phenylacetate is identified by CAS 102-20-5, molecular formula C16H16O2 and molecular weight 240.12 g/mol. UNII 5J5OJ7GH15; ChEBI 173735; InChIKey ZOZIRNMDEZKZHM-UHFFFAOYSA-N. Boiling Point: 324.00 to 325.00 °C. @ 760.00 mm Hg; Boiling Point: 325 °C; Melting Point: 28 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
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