dodecyl 4-chloro-3,5-dinitrobenzoate (CAS 94021-87-1) — formula C19H27ClN2O6, molecular weight 414.9.
dodecyl 4-chloro-3,5-dinitrobenzoate (CAS 94021-87-1) is classified under Food Additives, with molecular formula C19H27ClN2O6 and molecular weight 414.9, and serves as a key raw material in the food and beverage industry — commonly applied as a food additive, nutritional supplement, or processing aid where regulatory-grade purity is required. Jinan Shenghe Chemical Co., Ltd. supplies dodecyl 4-chloro-3,5-dinitrobenzoate at commercial scale with stable lot-to-lot quality, accompanied by COA and full specification documentation. Typical categorization: Food Additives.
| CAS Number | 94021-87-1 |
|---|---|
| Molecular Formula | C19H27ClN2O6 |
| Molecular Weight | 414.9 |
| LogP | 7.2 |
dodecyl 4-chloro-3,5-dinitrobenzoate is a chemical compound with CAS registry number 94021-87-1 and molecular formula C19H27ClN2O6 (molecular weight 414.9).
CAS number: 94021-87-1
Its molecular formula C19H27ClN2O6 comprises 19 C, 27 H, 1 Cl, 2 N, 6 O atoms.
Also known as: dodecyl 4-chloro-3,5-dinitrobenzoate · 4-氯-3,5-二硝基苯甲酸十二烷基酯
The CAS registry number of dodecyl 4-chloro-3,5-dinitrobenzoate is 94021-87-1.
Molecular formula C19H27ClN2O6, molecular weight 414.9.
It is also registered under: dodecyl 4-chloro-3,5-dinitrobenzoate, 4-氯-3,5-二硝基苯甲酸十二烷基酯.
Independent reference data for dodecyl 4-chloro-3,5-dinitrobenzoate (CAS 94021-87-1), compiled from public chemistry databases.
| CAS 号 | 94021-87-1 |
|---|---|
| PubChem CID | 3023288 |
| 分子式 | C19H27ClN2O6 |
| IUPAC 名称 | dodecyl 4-chloro-3,5-dinitrobenzoate |
| UNII（FDA） | NS00039901 |
| Molecular Weight | 414.9 |
|---|---|
| XLogP3 | 7.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 13 |
| Exact Mass | 414.1557643 |
| Monoisotopic Mass | 414.1557643 |
| Topological Polar Surface Area | 118 |
| Heavy Atom Count | 28 |
Dodecyl 4-chloro-3,5-dinitrobenzoate; 94021-87-1; EINECS 301-479-1; DTXSID30240250; RefChem:135477; DTXCID30162741; 301-479-1; SCHEMBL11341084; NKXANKOKHSNAJJ-UHFFFAOYSA-N; NS00039901
4-氯-3,5-二硝基苯甲酸十二烷基酯 · CAS 94021-87-1 · C19H27ClN2O6. UNII NS00039901.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-氯-3,5-二硝基苯甲酸十二烷基酯