基本情報
- 標準SMILES
Cc1cccc(CCl)n1.Cl- InChIKey
QFLPSIUFCCCRMI-UHFFFAOYSA-N- 分子式
- C7H9Cl2N
- 平均分子量
- 178.06 g/mol
- 単同位体質量
- 177.01120465
名称と識別子
- 優先名称
- 6-Chloromethyl-2-methylpyridinium chloride
- IUPAC
- 2-(chloromethyl)-6-methylpyridine;hydrochloride
名称と別名
6-Chloromethyl-2-methylpyridinium chlorideRefChem:541943221-451-13099-30-72-(Chloromethyl)-6-methylpyridine hydrochlorideMFCD01691969Pyridine, 2-(chloromethyl)-6-methyl-, hydrochloridePyridine, 2-(chloromethyl)-6-methyl-, hydrochloride (1:1)2-(Chloromethyl)-6-methylpyridine, HCl, tech grade2-(chloromethyl)-6-methylpyridine;hydrochlorideNSC-665142-Methyl-6-chloromethylpyridine hydrochloride
名称をさらに表示
NSC 66514EINECS 221-451-12-(chloromethyl)-6-methylpyridinium chlorideFG5YQ7W2YR2-(CHLOROMETHYL)-6-METHYLPYRIDINE HCL2-(Chloromethyl)-6-methylpyridinehydrochloride2-(chloromethyl)-6-methyl-pyridine hydrochloride2-(chloromethyl)-6-methylpyridine monohydrochloride
データベース識別子
- CAS
3099-30-7- PubChem CID
- 76545
- DTXSID
DTXSID60184976- UNII
- FG5YQ7W2YR
- EC Number
- 221-451-1
物性
構造計算による物性
- 極性表面積
- 12.9 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 1
- 回転可能結合数
- 1
- 重原子数
- 10
- 形式電荷
- 0
- 複雑度
- 85
安全と法規制
GHS分類
GHS Classification
Danger
H290 (50%): May be corrosive to metals [Warning Corrosive to Metals]
P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Hazard Classes and CategoriesMet. Corr. 1 (50%)
関連反応
19 件
関連ノート
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