(2-phenylethyl)hydrazine; sulfuric acid

• ChemBase编号: 104494
• 分子式: C8H14N2O4S
• 平均质量: 234.27276
• 单一同位素质量: 234.06742794
• SMILES: NNCCc1ccccc1.OS(=O)(=O)O
• Canonical SMILES: OS(=O)(=O)O.NNCCc1ccccc1
• InChI: InChI=1S/C8H12N2.H2O4S/c9-10-7-6-8-4-2-1-3-5-8;1-5(2,3)4/h1-5,10H,6-7,9H2;(H2,1,2,3,4)
• InChIKey: RXBKMJIPNDOHFR-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (2-phenylethyl)hydrazine; sulfuric acid
• IUPAC传统名: phenelzine; sulfuric acid
• 别名: (2-Phenylethyl)hydrazine dihydrogen sulfate; (β-Phenylethyl)hydrazine dihydrogen sulfate; 2-Phenethylhydrazine sulfate; Estinerval; Fenelzin; Kalgan; Mao-rem; NSC 170957; Nardelzine; Nardil; Phenelzine Acid Sulfate; Phenelzine Bisulfate; Phenelzine Dihydrogen Sulfate; Phenelzine Hydrogen Sulfate; Phenethylhydrazine Sulfate; Stinerval; W 1544A; Phenelzine Sulfate; PHENELZINE SULFATE SALT; Phenelzine sulfate salt

登记号

• CAS号: 156-51-4
• EC号: 205-856-0
• MDL号: MFCD00050687
• PubChem SID: 24278646; 162091880
• PubChem CID: 61100

理论计算性质

• 质子受体: 2
• 质子供体: 2
• LogD (pH = 5.5): 0.87542254
• LogD (pH = 7.4): 1.1969012
• Log P: 1.2030201
• 摩尔折射率: 54.2633 cm^3
• 极化性: 16.82067 Å^3
• 极化表面积: 38.05 Å^2
• 可自由旋转的化学键: 3
• 里宾斯基五规则: true

分子性质

安全信息

• 保存条件: Room Temperature (15-30°C)
• RTECS编号: MV8750000
• 欧盟危险性物质标志: 有害性(Harmful) (Xn)
• 联合国危险货物编号: 2811
• 德国WGK号: 3
• 联合国危险货物等级: 6.1
• 联合国危险货物包装类别(PG): 3
• 危险公开号: 22; R:22
• 安全公开号: S:36/37/39
• GHS危险品标识: GHS06
• GHS警示词: Danger
• GHS危险声明: H301
• GHS警示性声明: P301 + P310
• 个人保护装置: dust mask type N95 (US), Eyeshields, Faceshields, Gloves
• RID/ADR: UN 2811 6.1/PG 3

药理学性质

• 相关基因信息: human ... MAOA(4128), MAOB(4129)

产品相关信息

• 纯度: ≥97%

详细说明

MP Biomedicals - 02156136

Sulfate Salt
Purity: >97%

Sigma Aldrich - P6777

Biochem/physiol Actions
Non-selective MAO-A/B inhibitor.

Toronto Research Chemicals - P295900

A hydrazine derivative that is a non-selective and irreversible monoamine oxidase inhibitor (MAOI) and also inhibits GABA-transaminase (GABA-T), markedly increasing brain GABA levels. It is an antidepressant and anxiolytic used in the treatment of major d

参考文献

• Chiche, F. et al.: Mol. Pharmacol., 75, 1052 (2008)
• McKenna, K.F, et al.: J. Neural Trans., 41, 115 (2008)
• MacKenzie, E.M. et al.: Neurochem. Res., 33, 430 (2008)