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3-methylbutyl 2-[2-(diethylamino)ethylamino]-2-phenylacetate

Dangerous Goods

CAS number:54-30-8    molecular formula:C19H32N2O2

overview

compound introduction

2-[2-(二乙基氨基)乙基氨基]-2-苯基乙酸3-甲基丁酯是一种α-氨基酸酯。

Specs

Chinese alias-
English aliasAvocan | Tox21_112157_1 | 3-methyl butyl 2-(2-diethyl amino ethyl amino)-2-phenyl acetate | CHEBI:95216 | Belosin | Camilofina [INN-Spanish] | DTXSID7046415 | Adopon | B-Diethylaminoethylaminophenylacetic acid isoamyl ester | Camylofin | Acamylophenine HC
CAS number54-30-8molecular formulaC19H32N2O2
molecular weight320.5Exact mass-
PSA41.6logp3.9

numbering system

CAS54-30-8
UNII340B6Q764V
KEGG IDD07076
ChEBI ID95216
WikidataQ4725854
ChEMBL IDCHEMBL253592
WikipediaCamylofin
DrugBank IDDB13738
DrugCentral472
PubChem CID5902
Related CAS5892-41-1 (二盐酸盐)
Nikkaji NumberJ38.359G
NCI 词表代码C166637
DSSTox Substance IDDTXSID7046415
Metabolomics Workbench ID144340
European Community (EC) Number200-202-0
PubChem Reference Collection SID500766588
International Nonproprietary Names (INN)CAMYLOFIN

physicochemical properties

XLogP3XLogP3-AA: 3.9
复杂性310
Exact Mass320.246378268
形式电荷0
重原子计数23
Molecular Weight320.5
Monoisotopic Mass320.246378268
可旋转键计数12
氢键供体计数1
氢键受体计数4
共价键单元计数1
同位素原子计数0
拓扑极性表面积41.6 Ų
定义键立体中心计数0
定义原子立体中心计数0
未定义键立体中心计数0
未定义原子手性中心计数1

Safety information

危害类别和分类:
急性毒性 4 (100%)

Production methods and uses

purpose
工业应用参考:
工业分类参考:医药制造业。 应用场景参考:可延伸到医疗、生物医药、科研院所及第三方检测等专业场景,但具体适用范围仍依赖技术条件 。 作用参考:在科研材料体系中具备较强的组合应用潜力,价值往往取决于具体配方、纯度等级和工艺设计 。 选型提示:涉及安全应用管理时,仍应以 MSDS、产品详情页和现场工艺控制要求为准,不应由参考文案替代 。

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downstream information

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MSDS

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