3-phenylpropyl propionate (CAS 122-74-7) — formula C12H16O2, molecular weight 192.12 g/mol; category organic chemicals.
| CAS Number | 122-74-7 |
|---|---|
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.12 g/mol |
| Boiling Point | 279.00 to 280.00 °C. @ 760.00 mm Hg |
| LogP | 3 |
| Category | Organic Chemicals |
3-phenylpropyl propionate is a carbon-based organic compound with CAS registry number 122-74-7 and molecular formula C12H16O2 (molecular weight 192.12 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 122-74-7
Its molecular formula C12H16O2 comprises 12 C, 16 H, 2 O atoms.
Also known as: 3-phenylpropyl propionate · 苯丙醇丙酸盐
Category: organic chemicals
The CAS registry number of 3-phenylpropyl propionate is 122-74-7.
Molecular formula C12H16O2, molecular weight 192.12 g/mol.
It is also registered under: 3-phenylpropyl propionate, 苯丙醇丙酸盐.
Category: Organic Chemicals.
Independent reference data for 3-phenylpropyl propionate (CAS 122-74-7), compiled from public chemistry databases.
| CAS Registry Number | 122-74-7 |
|---|---|
| PubChem CID | 61052 |
| Molecular formula | C12H16O2 |
| Molecular weight | 192.12 g/mol |
| IUPAC name | 3-phenylpropyl propanoate |
| InChIKey | GTNCESCYZPMXCJ-UHFFFAOYSA-N |
| UNII (FDA) | C4756E9F55 |
| ChEBI ID | CHEBI:179906 |
| FEMA number | 2897 |
| JECFA number | 639 |
| Molecular Weight | 192.25 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 192.115029749 |
| Monoisotopic Mass | 192.115029749 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
| Boiling Point | 279.00 to 280.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 265 °C |
| Density | 0.995-1.005 |
| Refractive Index | 1.488-1.495 |
3-Phenylpropyl propanoate; 3-Phenylpropyl propionate; 122-74-7; Hydrocinnamyl propionate; Phenylpropyl propionate; Benzenepropanol, 1-propanoate; BENZENEPROPANOL, PROPANOATE; 3-Phenyl-1-propanol propionate; 1-Propanol, 3-phenyl-, propionate; FEMA No. 2897; NSC 6032; EINECS 204-571-9; BRN 3272005; AI3-18535; NSC-6032; C4756E9F55
| 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 | 85.8% (235 / 274) |
| GHS notification summary | 85.8% (235 / 274) |
|---|---|
| Reported hazard statements | H315 (14.2%), H319 (14.2%), H335 (14.2%) |
This chemical does not meet GHS hazard criteria for 85.8% (235 of 274) of all reports.
H315 (14.2%): Causes skin irritation [Warning Skin corrosion/irritation]
3-phenylpropyl propionate is identified by CAS 122-74-7, molecular formula C12H16O2 and molecular weight 192.12 g/mol. UNII C4756E9F55; ChEBI 179906; InChIKey GTNCESCYZPMXCJ-UHFFFAOYSA-N. Boiling Point: 279.00 to 280.00 °C. @ 760.00 mm Hg; Boiling Point: 265 °C; Density: 0.995-1.005.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 苯丙醇丙酸盐