O-(cyclopropylmethyl)hydroxylamine hydrochloride

• ChemBase编号: 165270
• 分子式: C4H10ClNO
• 平均质量: 123.5813
• 单一同位素质量: 123.04509163
• SMILES: C1(CC1)CON.Cl
• Canonical SMILES: NOCC1CC1.Cl
• InChI: InChI=1S/C4H9NO.ClH/c5-6-3-4-1-2-4;/h4H,1-3,5H2;1H
• InChIKey: HMMFZNBOQJOULD-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: O-(cyclopropylmethyl)hydroxylamine hydrochloride
• IUPAC传统名: O-(cyclopropylmethyl)hydroxylamine hydrochloride
• 别名: Cyclopropylmethoxyamine, Hydrochloride; Cyclopropylmethoxylamine, Hydrochloride; O-Cyclopropylmethyl-hydroxylamine, Hydrochloride; O-(CyclopropylMethyl)hydroxylaMine hydrochloride

登记号

• CAS号: 74124-04-2
• PubChem SID: 162259403
• PubChem CID: 11557279

理论计算性质

• 质子受体: 2
• 质子供体: 1
• LogD (pH = 5.5): 0.38498294
• LogD (pH = 7.4): 0.41760936
• Log P: 0.41804162
• 摩尔折射率: 24.273 cm^3
• 极化性: 9.589044 Å^3
• 极化表面积: 35.25 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: Dimethyl Sulfoxide; Methanol; Water
• 外观: White Solid
• 熔点: 170-172°C

安全信息

• 保存条件: -20°C Freezer

产品相关信息

• 纯度: 97%