结构:Cn1c(=O)c2c(ncn2CCCCl)n(C)c1=O
HCID76011

7-(3-Chloropropyl)theophylline

7-(3-Chloropropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

C10H13ClN4O2256.693 g/molCAS 2770-66-3

IDENTITY

结构与身份

标准 SMILES
Cn1c(=O)c2c(ncn2CCCCl)n(C)c1=O
InChIKey
MORVOYPJRATMRS-UHFFFAOYSA-N
分子式
C10H13ClN4O2
平均分子量
256.693 g/mol
单同位素质量
256.07270334
扩展信息尚未完成同步。

REACTIONS

参与反应

7
HRID100696

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物
HRID 100696 方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看条件与参与物
HRID934700

Validation data from https://doi.org/10.1039/C8SC04228D

作为反应物
HRID 934700 方程式

Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

查看条件与参与物
HRID1144527

Training data from https://doi.org/10.1039/C8SC04228D (7/10)

作为反应物
HRID 1144527 方程式

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

查看条件与参与物