托莫西汀

CAS 83015-26-3C17H21NOMW 255.35

托莫西汀（CAS 83015-26-3）：分子式 C17H21NO、分子量 255.35。

产品概览

CAS号	83015-26-3
分子式	C17H21NO
分子量	255.35
熔点	161-165 ºC
沸点	64-65 ºC at 0.760 mmHg
LogP	0.676
应用领域	Uses: MEDICATION、Adrenergic Uptake Inhibitors、Use (kg、approx.) in Germany (2009): >250、Consumption (g per capita、approx.) in Germany (2009): 0.00305、Calculated removal (%): 76.8、For the treatment of Attention-Deficit、Hyperactivity Disorder (ADHD) alone or in combination with behavioral treatment、as an adjunct to psychological、educational、social、and other remedial measures.、Methods of Manufacturing: Preparation (stereochemistry unspecified): B. B. Molloy、K. K. Schmiegel、German patent 2500110、eidem、United States of America patent 4314081 (1975、1982 both to Lilly). Preparation of (R)-form: B. J. Foster、E. R. Lavagnino、European Patent Office patent 52492 (1982 to Lilly).、Formulations、Preparations: Table: Atomoxetine Hydrochloride Preparations [Table#6934]

应用领域

登记用途：Uses: MEDICATION、Adrenergic Uptake Inhibitors、Use (kg、approx.) in Germany (2009): >250、Consumption (g per capita、approx.) in Germany (2009): 0.00305、Calculated removal (%): 76.8、For the treatment of Attention-Deficit、Hyperactivity Disorder (ADHD) alone or in combination with behavioral treatment、as an adjunct to psychological、educational、social、and other remedial measures.、Methods of Manufacturing: Preparation (stereochemistry unspecified): B. B. Molloy、K. K. Schmiegel、German patent 2500110、eidem、United States of America patent 4314081 (1975、1982 both to Lilly). Preparation of (R)-form: B. J. Foster、E. R. Lavagnino、European Patent Office patent 52492 (1982 to Lilly).、Formulations、Preparations: Table: Atomoxetine Hydrochloride Preparations [Table#6934]。

技术档案

这个产品是什么

托莫西汀是一种化工化合物，登记 CAS 号为 83015-26-3，分子式 C17H21NO（分子量 255.35）。

识别信息

登记 CAS 号：83015-26-3

其分子式 C17H21NO 由 17 个碳、21 个氢、1 个氮、1 个氧组成。

别名/同义词：托莫西汀 · Tomoxetine

常见问题

托莫西汀的 CAS 号是多少？

托莫西汀的 CAS 登记号为 83015-26-3。

托莫西汀的分子式与分子量是多少？

分子式 C17H21NO，分子量 255.35。

托莫西汀还有哪些别名？

别名/同义词：托莫西汀、Tomoxetine。

托莫西汀的登记用途是什么？

PubChem 公开数据

托莫西汀（CAS 83015-26-3）的独立参考数据，整理自公开化学数据库。

各数据库的登记标识

CAS Registry Number	83015-26-3
PubChem CID	54841
Molecular formula	C17H21NO
IUPAC name	(3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine
UNII (FDA)	ASW034S0B8

计算分子描述符

Molecular Weight	255.35
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Exact Mass	255.162314293
Monoisotopic Mass	255.162314293
Topological Polar Surface Area	21.3
Heavy Atom Count	19

在册的理化数值

Boiling Point	64-65 ºC at 0.760 mmHg
Melting Point	161-165 ºC
Solubility	27.8
Solubility	3.90e-03 g/L
LogP	0.676
LogP	3.9
Dissociation Constants	10.1
Dissociation Constants	10.13

在册的记载用途

同义词与商品名

Atomoxetine; 83015-26-3; Tomoxetine; (-)-Tomoxetine; Tomoxetina; Tomoxetinum; Tomoxetinum [Latin]; Atomoxetina; ASW034S0B8; methyl[(3R)-3-(2-methylphenoxy)-3-phenylpropyl]amine; DTXSID9044297; Benzenepropanamine, N-methyl-gamma-(2-methylphenoxy)-, (gammaR)-; CHEBI:127342; AD313 COMPONENT ATOMOXETINE; AD-313 COMPONENT ATOMOXETINE; Tomoxetinum (Latin)

GHS 危害分类

Reported hazard statements	H301, H331 (33.3%), H318 (66.7%), H361 (66.7%), H411 (66.7%)

H301+H331 (33.3%): Toxic if swallowed or if inhaled [Danger Acute toxicity, oral; acute toxicity, inhalation]

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

公开数据库对它的描述

Tomoxetine · CAS 83015-26-3 · C17H21NO. UNII ASW034S0B8. Boiling Point: 64-65 ºC at 0.760 mmHg; Melting Point: 161-165 ºC; Solubility: 27.8.

物理形态与操作说明

数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。