Isopropyl Phenylacetate (CAS 4861-85-2) — formula C11H14O2, molecular weight 178.23; category organic chemicals.
Isopropyl Phenylacetate (CAS 4861-85-2) is a chemical raw material in the organic chemicals category. Its molecular formula C11H14O2 comprises 11 C, 14 H, 2 O atoms. Its molecular weight is about 178.23. Reported physicochemical data: boiling point around 486 to 489 °F at 760 mmHg (NTP, 1992), LogP about 2.6. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 4861-85-2 |
|---|---|
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.23 |
| Boiling Point | 486 to 489 °F at 760 mmHg (NTP, 1992) |
| LogP | 2.6 |
| Applications | Flavouring Agent, Flavoring Agents, Benzeneacetic acid, 1-methylethyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Flavouring Agent, Flavoring Agents, Benzeneacetic acid, 1-methylethyl ester: ACTIVE.
Isopropyl Phenylacetate is a carbon-based organic compound with CAS registry number 4861-85-2 and molecular formula C11H14O2 (molecular weight 178.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4861-85-2
Its molecular formula C11H14O2 comprises 11 C, 14 H, 2 O atoms.
Also known as: Isopropyl Phenylacetate · 苯乙酸异丙酯
Category: organic chemicals
The CAS registry number of Isopropyl Phenylacetate is 4861-85-2.
Molecular formula C11H14O2, molecular weight 178.23.
It is also registered under: Isopropyl Phenylacetate, 苯乙酸异丙酯.
Recorded applications: Flavouring Agent, Flavoring Agents, Benzeneacetic acid, 1-methylethyl ester: ACTIVE.
Category: Organic Chemicals.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Isopropyl Phenylacetate (CAS 4861-85-2), compiled from public chemistry databases.
| CAS Registry Number | 4861-85-2 |
|---|---|
| PubChem CID | 62553 |
| Molecular formula | C11H14O2 |
| IUPAC name | propan-2-yl 2-phenylacetate |
| UNII (FDA) | A8L7NAJ0YO |
| FEMA number | 2956 |
| JECFA number | 1011 |
| Molecular Weight | 178.23 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 178.099379685 |
| Monoisotopic Mass | 178.099379685 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 13 |
| Boiling Point | 486 to 489 °F at 760 mmHg (NTP, 1992) |
|---|---|
| Boiling Point | 157.00 to 165.00 °C. @ 12.00 mm Hg |
| Boiling Point | 238-253 °C |
| Flash Point | 203 °F (NTP, 1992) |
| Density | 1.006-1.012 (20 °C) |
| Refractive Index | 1.483-1.491 |
Isopropyl phenylacetate; propan-2-yl 2-phenylacetate; Benzeneacetic acid, 1-methylethyl ester; Benzeneacetic acid 1-methylethyl ester; 1-Methylethyl benzeneacetate; FEMA No. 2956; Acetic acid, phenyl-, isopropyl ester; DTXSID1025483; UNII-A8L7NAJ0YO; A8L7NAJ0YO; EINECS 225-468-5; Phenylacetic acid, isopropyl ester; ISOPROPYL BENZENEACETATE; DTXCID905483; ISOPROPYL PHENYLACETATE [FHFI]; RefChem:149834
| 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 |
|---|
Isopropyl Phenylacetate · CAS 4861-85-2 · C11H14O2. UNII A8L7NAJ0YO. Boiling Point: 486 to 489 °F at 760 mmHg (NTP, 1992); Boiling Point: 157.00 to 165.00 °C. @ 12.00 mm Hg; Boiling Point: 238-253 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 苯乙酸异丙酯