uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440948B2
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IDENTITY
结构与身份
- 标准SMILES
- CC1=NCCc2ccccc21
- InChIKey
- JZZLDIIDMFCOGF-UHFFFAOYSA-N
- 分子式
- C10H11N
- 平均分子量
- 145.2 g/mol
- 单同位素质量
- 145.08914936
COMPUTED
结构计算性质
- XLogP
- 1.6
- 极性表面积
- 12.4 Ų
- 氢键供体
- 0
- 氢键受体
- 1
- 可旋转键
- 0
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 172
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1-Methyl-3,4-dihydroisoquinoline2412-58-0DTXSID309469471MeDIQ compoundRefChem:76249DTXCID80929301800-807-5NSC27893MFCD00047648SCHEMBL30310orb2645542SCHEMBL29385430SCHEMBL306952701-methyl-3,4-dihyroisoquinoline1-methyl-3,4 dihydroisoquinoline1-methyl-3,4-dihydro-isoquinolineCAA41258NSC-27893AKOS006229266SY119876
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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uspto-grants-1999_07 · 10.6084/m9.figshare.5104873.v1 · US05929085
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uspto-grants-2001_08 · 10.6084/m9.figshare.5104873.v1 · US06277861B1
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uspto-grants-1988_07 · 10.6084/m9.figshare.5104873.v1 · US04755218
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