Benzenamine, 4-(4-(2-chlorophenyl)-2,5-dihydro-2,2-dimethyl-5-oxazolyl)-N,N-dimethyl-
基本情報
- CAS
79213-88-0- 標準SMILES
CN(C)c1ccc(C2OC(C)(C)N=C2c2ccccc2Cl)cc1- InChIKey
XYMKMRDSRQKFAR-UHFFFAOYSA-N- 分子式
- C19H21ClN2O
- 平均分子量
- 328.8 g/mol
- 単同位体質量
- 328.134241
名称と識別子
- 優先名称
- Benzenamine, 4-(4-(2-chlorophenyl)-2,5-dihydro-2,2-dimethyl-5-oxazolyl)-N,N-dimethyl-
- IUPAC
- 4-[4-(2-chlorophenyl)-2,2-dimethyl-5H-1,3-oxazol-5-yl]-N,N-dimethylaniline
名称と別名
3-Oxazoline, 4-(o-chlorophenyl)-2,2-dimethyl-5-(p-(dimethylamino)phenyl)-79213-88-04-(4-(2-Chlorophenyl)-2,5-dihydro-2,2-dimethyl-5-oxazolyl)-N,N-dimethylbenzenamine4-(o-Chlorphenyl)-5-(p-(dimethylamino)phenyl)-2,2-dimethyl-delta(sup 3)-1,3-oxazolin [German]Benzenamine, 4-(4-(2-chlorophenyl)-2,5-dihydro-2,2-dimethyl-5-oxazolyl)-N,N-dimethyl-4-(o-Chlorphenyl)-5-(p-(dimethylamino)phenyl)-2,2-dimethyl-delta(sup 3)-1,3-oxazolinRefChem:322892SCHEMBL11095225XYMKMRDSRQKFAR-UHFFFAOYSA-NDTXSID0010003384-(o-chlorophenyl)-5-[p-(dimethylamino)phenyl]-2,2-dimethyl-3-oxazoline4-[4-(2-Chlorophenyl)-2,2-dimethyl-2,5-dihydro-1,3-oxazol-5-yl]-N,N-dimethylaniline
データベース識別子
- CAS
79213-88-0- PubChem CID
- 3061436
- DTXSID
DTXSID001000338
物性
構造計算による物性
- XLogP
- 4.4
- 極性表面積
- 24.8 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 3
- 回転可能結合数
- 3
- 重原子数
- 23
- 形式電荷
- 0
- 複雑度
- 441
関連反応
3 件
化合物ノート
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