4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone (CAS 81-14-1) — formula C14H18N2O5, molecular weight 294.30; category organic chemicals.
4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone (CAS 81-14-1) is a chemical raw material in the organic chemicals category. Its molecular formula C14H18N2O5 comprises 14 C, 18 H, 2 N, 5 O atoms. Its molecular weight is about 294.30. Reported physicochemical data: melting point around 274.1 to 277.7 °F (NTP, 1992), LogP about log Kow = 4.30. 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 | 81-14-1 |
|---|---|
| Molecular Formula | C14H18N2O5 |
| Molecular Weight | 294.30 |
| Melting Point | 274.1 to 277.7 °F (NTP, 1992) |
| LogP | log Kow = 4.30 |
| Applications | Musk ketone is widely used as a fixative in blossom and fantasy compositions, Fragrance, Fragrance Ingredients, Cosmetics, Household Products: Information on 9 consumer products that contain Musk ketone in the following categories is provided, • Auto Products |
| Category | Organic Chemicals |
Documented applications: Musk ketone is widely used as a fixative in blossom and fantasy compositions, Fragrance, Fragrance Ingredients, Cosmetics, Household Products: Information on 9 consumer products that contain Musk ketone in the following categories is provided, • Auto Products.
4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone is a carbon-based organic compound with CAS registry number 81-14-1 and molecular formula C14H18N2O5 (molecular weight 294.30), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81-14-1
Its molecular formula C14H18N2O5 comprises 14 C, 18 H, 2 N, 5 O atoms.
Also known as: 4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone · 4-叔丁基-2,6-二甲基-3,5-二硝基苯乙酮
Category: organic chemicals
The CAS registry number of 4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone is 81-14-1.
Molecular formula C14H18N2O5, molecular weight 294.30.
It is also registered under: 4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone, 4-叔丁基-2,6-二甲基-3,5-二硝基苯乙酮.
Recorded applications: Musk ketone is widely used as a fixative in blossom and fantasy compositions, Fragrance, Fragrance Ingredients, Cosmetics, Household Products: Information on 9 consumer products that contain Musk ketone in the following categories is provided, • Auto Products.
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 4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone (CAS 81-14-1), compiled from public chemistry databases.
| CAS Registry Number | 81-14-1 |
|---|---|
| PubChem CID | 6669 |
| Molecular formula | C14H18N2O5 |
| IUPAC name | 1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone |
| UNII (FDA) | 483V3E1L6J |
| Molecular Weight | 294.30 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 294.12157168 |
| Monoisotopic Mass | 294.12157168 |
| Topological Polar Surface Area | 109 |
| Heavy Atom Count | 21 |
| Melting Point | 274.1 to 277.7 °F (NTP, 1992) |
|---|---|
| Melting Point | 135.5 °C |
| Melting Point | 135.5 - 136 °C |
| Flash Point | >168 °C (>334 °F) - closed cup |
| Solubility | In water, 0.46 mg/L at 25 °C |
| Solubility | 0.00046 mg/mL |
| Vapor Pressure | 3.00X10-7 mm Hg at 25 °C |
| LogP | log Kow = 4.30 |
| LogP | 4.30 |
MUSK KETONE; 81-14-1; 4'-tert-Butyl-2',6'-dimethyl-3',5'-dinitroacetophenone; 2-Acetyl-5-tert-butyl-4,6-dinitroxylene; DTXSID6025690; Acetophenone, 4'-tert-butyl-2',6'-dimethyl-3',5'-dinitro-; 3,5-Dinitro-2,6-dimethyl-4-tert-butylacetophenone; 4-tert-Butyl-3,5-dinitro-2,6-dimethylacetophenone; 2,6-Dinitro-3,5-dimethyl-4-acetyl-tert-butylbenzene; 2,6-Dimethyl-3,5-dinitro-4-t-butylacetophenone; 4-tert-Butyl-2,6-dimethyl-3,5-dinitroacetophenone; 483V3E1L6J; 1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethan-1-one; NSC-15339; 1-(4-(1,1-Dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl)ethanone; Ethanone, 1-(4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl)-
| Regulatory & Food Contact | FDA Substance added to food: FLAVORING AGENT OR ADJUVANT MUSK, KETONE |
|---|
| Reported hazard statements | H351, H400, H410, H336, H361 |
|---|
H351: Suspected of causing cancer [Warning Carcinogenicity]
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
4-tert-butyl-2,6-dimethyl-3,5-dinitroacetophenone · CAS 81-14-1 · C14H18N2O5. UNII 483V3E1L6J. Melting Point: 274.1 to 277.7 °F (NTP, 1992); Melting Point: 135.5 °C; Melting Point: 135.5 - 136 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-叔丁基-2,6-二甲基-3,5-二硝基苯乙酮