2-Acetyl-1-pyrroline (CAS 85213-22-5) — formula C6H9NO, molecular weight 111.07 g/mol; category food flavors.
2-Acetyl-1-pyrroline (CAS 85213-22-5) is a food flavors. Its molecular formula C6H9NO comprises 6 C, 9 H, 1 N, 1 O atoms. Its molecular weight is about 111.07 g/mol. Reported physicochemical data: melting point around 19.00 °C. @ 760.00 mm Hg, boiling point around 182.00 to 183.00 °C. @ 760.00 mm Hg, LogP about -0.4. Flavors are used to provide or enhance aroma in food and beverages, and must comply with food flavoring regulations. Widely used in beverages, confectionery, baking, dairy and convenience foods to build or complement flavor profiles. 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 | 85213-22-5 |
|---|---|
| Molecular Formula | C6H9NO |
| Molecular Weight | 111.07 g/mol |
| Melting Point | 19.00 °C. @ 760.00 mm Hg |
| Boiling Point | 182.00 to 183.00 °C. @ 760.00 mm Hg |
| LogP | -0.4 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering |
| Category | Flavors |
Documented applications: confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
2-Acetyl-1-pyrroline is a flavoring compound with CAS registry number 85213-22-5 and molecular formula C6H9NO (molecular weight 111.07 g/mol), belonging to the food flavors segment of chemical raw materials.
CAS number: 85213-22-5
Its molecular formula C6H9NO comprises 6 C, 9 H, 1 N, 1 O atoms.
Also known as: 2-Acetyl-1-pyrroline · 2-乙酰基-1-吡咯啉
Category: food flavors
The CAS registry number of 2-Acetyl-1-pyrroline is 85213-22-5.
Molecular formula C6H9NO, molecular weight 111.07 g/mol.
It is also registered under: 2-Acetyl-1-pyrroline, 2-乙酰基-1-吡咯啉.
Recorded applications: confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
Category: Flavors.
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 2-Acetyl-1-pyrroline (CAS 85213-22-5), compiled from public chemistry databases.
| CAS Registry Number | 85213-22-5 |
|---|---|
| PubChem CID | 522834 |
| Molecular formula | C6H9NO |
| Molecular weight | 111.07 g/mol |
| IUPAC name | 1-(3,4-dihydro-2H-pyrrol-5-yl)ethanone |
| InChIKey | DQBQWWSFRPLIAX-UHFFFAOYSA-N |
| UNII (FDA) | IGC0W6LY94 |
| ChEBI ID | CHEBI:67125 |
| JECFA number | 1604 |
| Molecular Weight | 111.14 |
|---|---|
| XLogP3 | -0.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 111.068413911 |
| Monoisotopic Mass | 111.068413911 |
| Topological Polar Surface Area | 29.4 |
| Heavy Atom Count | 8 |
| Boiling Point | 182.00 to 183.00 °C. @ 760.00 mm Hg |
|---|---|
| Melting Point | 19.00 °C. @ 760.00 mm Hg |
2-Acetyl-1-pyrroline; 85213-22-5; 1-(3,4-Dihydro-2H-pyrrol-5-yl)ethanone; CHEBI:67125; DTXSID40335080; RefChem:84964; DTXCID40286169; FEMA NO. 4249; IGC0W6LY94; ETHANONE, 1-(3,4-DIHYDRO-2H-PYRROL-5-YL)-; 1-(3,4-dihydro-2H-pyrrol-5-yl)ethan-1-one; 2-acetyl-4,5-dihydro-3H-pyrrole; 1-Pyrroline, 2-acetyl; 2-Acetyl-1-pyrroline-13C2 85% (10% w/w in DCM); 5-Acetyl-3,4-dihydro-2H-pyrrole; 2-Acetyl-1-pyrroline, ~10% w/w in Toluene
| Regulatory & Food Contact | FLAVOURING_AGENT: Flavouring Agent Flavoring Agents No safety concern at current levels of intake when used as a flavouring agent ">TRS 952-JECFA 69/155 ">FAS 60-JECFA 69/629 |
|---|
2-Acetyl-1-pyrroline is identified by CAS 85213-22-5, molecular formula C6H9NO and molecular weight 111.07 g/mol. UNII IGC0W6LY94; ChEBI 67125; InChIKey DQBQWWSFRPLIAX-UHFFFAOYSA-N. Boiling Point: 182.00 to 183.00 °C. @ 760.00 mm Hg; Melting Point: 19.00 °C. @ 760.00 mm Hg.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-乙酰基-1-吡咯啉