2-cyanobenzoyl chloride (CAS 27611-63-8) — formula C8H4ClNO, molecular weight 165.57; category inorganic chemicals.
2-cyanobenzoyl chloride is an inorganic compound with CAS registry number 27611-63-8 and molecular formula C8H4ClNO (molecular weight 165.57), belonging to the inorganic chemicals segment of chemical raw materials.
CAS number: 27611-63-8
Its molecular formula C8H4ClNO comprises 8 C, 4 H, 1 Cl, 1 N, 1 O atoms.
Also known as: 2-cyanobenzoyl chloride
Category: inorganic chemicals
The CAS registry number of 2-cyanobenzoyl chloride is 27611-63-8.
Molecular formula C8H4ClNO, molecular weight 165.57.
It is also registered under: 2-cyanobenzoyl chloride.
Category: Inorganic Chemicals.
Public-database records for 2-cyanobenzoyl chloride (CAS 27611-63-8), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (100%), H319 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
| CAS Registry Number | 27611-63-8 |
|---|---|
| PubChem CID | 119681 |
| 分子式 | C8H4ClNO |
| IUPAC 名称 | 2-cyanobenzoyl chloride |
| UNII（FDA） | NS00028334 |
2-Cyanobenzoyl chloride; 27611-63-8; EINECS 248-572-2; DTXSID10182003; RefChem:86579; DTXCID80104494; 248-572-2; 2-cyanobenzoylchloride; Benzoyl chloride, 2-cyano-; MFCD00053279; Benzoyl chloride,2-cyano-; 2-cyano-benzoyl chloride; 2-Cyanbenzoylchlorid; o-cyanobenzoyl chloride; SCHEMBL1340299; 2-cyanobenzoyl chloride, AldrichCPR
| 分子量 | 165.57 |
|---|---|
| XLogP3 | 2.1 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 1 |
| 精确质量 | 164.9981414 |
| 单同位素质量 | 164.9981414 |
| 拓扑极性表面积 | 40.9 |
| 重原子数 | 11 |
| 形式电荷 | 0 |
2-cyanobenzoyl chloride · CAS 27611-63-8 · C8H4ClNO. UNII NS00028334.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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