3-Chloro-5-nitrobenzotrifluoride (CAS 401-93-4) — formula C7H3ClF3NO2, molecular weight 225.55; category inorganic chemicals.
3-Chloro-5-nitrobenzotrifluoride is an inorganic compound with CAS registry number 401-93-4 and molecular formula C7H3ClF3NO2 (molecular weight 225.55), belonging to the inorganic chemicals segment of chemical raw materials.
CAS number: 401-93-4
Its molecular formula C7H3ClF3NO2 comprises 7 C, 3 H, 1 Cl, 3 F, 1 N, 2 O atoms.
Also known as: 3-Chloro-5-nitrobenzotrifluoride
Category: inorganic chemicals
The CAS registry number of 3-Chloro-5-nitrobenzotrifluoride is 401-93-4.
Molecular formula C7H3ClF3NO2, molecular weight 225.55.
It is also registered under: 3-Chloro-5-nitrobenzotrifluoride.
Category: Inorganic Chemicals.
Public-database records for 3-Chloro-5-nitrobenzotrifluoride (CAS 401-93-4), reproduced here for independent cross-checking.
| CAS Registry Number | 401-93-4 |
|---|---|
| PubChem CID | 50255 |
| 分子式 | C7H3ClF3NO2 |
| IUPAC 名称 | 1-chloro-3-nitro-5-(trifluoromethyl)benzene |
3-chloro-5-nitrobenzotrifluoride; 401-93-4; 1-chloro-3-nitro-5-(trifluoromethyl)benzene; MFCD03412202; 5-chloro-3-nitrobenzotrifluoride; 1-Chloro-3-nitro-5-trifluoromethyl-benzene; BENZENE, 1-CHLORO-3-NITRO-5-(TRIFLUOROMETHYL)-; 68849-24-1; 3-Chloro-5-nitrobenotrifluoride; 1-Chloro-3-nitro-5-(trifluoromethyl)benzene, 3-Chloro-5-(trifluoromethyl)nitrobenzene; 3-nitro-5-chlorobenzotrifluoride; 1-chloro-3-nitro-5-benzotrifluoride; 3-chloro-1-nitro-5-(trifluoromethyl)benzene; 5-chloro-3-trifluoromethyl-nitrobenzene; SCHEMBL1361857; SCHEMBL1531196
| 分子量 | 225.55 |
|---|---|
| XLogP3 | 3.3 |
| 氢键供体数 | 0 |
| 氢键受体数 | 5 |
| 可旋转键数 | 0 |
| 精确质量 | 224.9804405 |
| 单同位素质量 | 224.9804405 |
| 拓扑极性表面积 | 45.8 |
| 重原子数 | 14 |
| 形式电荷 | 0 |
3-Chloro-5-nitrobenzotrifluoride · CAS 401-93-4 · C7H3ClF3NO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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