2-phenylphenol

• ChemBase编号: 89396
• 分子式: C12H10O
• 平均质量: 170.2072
• 单一同位素质量: 170.07316494
• SMILES: Oc1c(cccc1)c1ccccc1
• Canonical SMILES: Oc1ccccc1c1ccccc1
• InChI: InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H
• InChIKey: LLEMOWNGBBNAJR-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-phenylphenol
• IUPAC传统名: o-phenylphenol
• 别名: 2-羟基联苯; 2-苯基苯酚; Biphenyl-2-ol; 2-Phenylphenol; o-HYDROXYBIPHENYL; 2-HYDROXYDIPHENYL; o-phenylphenol; biphenylol; 2-hydroxybiphenyl; orthophenyl phenol; o-xenol; orthoxenol; 2-Phenylphenol; [1,1'-biphenyl]-2-ol; 2-Phenylphenol; 2-Hydroxybiphenyl; o-Phenylphenol; 2-Biphenylol; 2-HYDROXYDIPHENYL; o-HYDROXYBIPHENYL

登记号

• CAS号: 90-43-7
• EC号: 201-993-5
• MDL号: MFCD00002208
• Beilstein号: 606907
• 默克索引号: 147304
• PubChem SID: 24901953; 24899228; 24869050; 24878943; 162076276; 24898365
• PubChem CID: 7017
• CHEBI ID: 17043
• ATC码: D08AE06
• CHEMBL: 108829
• Chemspider ID: 13839012
• FEMA编号: 3959
• KEGG ID: D08367
• 美国药典/FDA物质标识码: D343Z75HT8
• 维基百科标题: 2-Phenylphenol
• E编码: E232

理论计算性质

• Acid pKa: 9.694701
• 质子受体: 1
• 质子供体: 1
• LogD (pH = 5.5): 3.3168783
• LogD (pH = 7.4): 3.3147213
• Log P: 3.316906
• 摩尔折射率: 53.1751 cm^3
• 极化性: 22.017588 Å^3
• 极化表面积: 20.23 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

分子性质

理化性质

• 熔点: 54-58°C; 54-59°C; 56 - 58 °C; 56°C; 56-59 °C; 57.5 - 55.5°C; 57-59 °C(lit.)
• 沸点: 152-154°C/15mm; 282 °C(lit.); 282-287°C; 284 - 280°C; 286 °C at 1013 hPa; 286°C
• 闪点: 124 °C; 124°C; 124°C(255°F); 138 °C (closed cup and DIN 51758); 255.2 °F
• 自燃点: 530 °C (986 °F)
• 密度: 1.26 g/cm^3 at 20 °C; 1.26g/ml; 1.293; 1.293 g/cm3
• 蒸汽压: .0007 hPa at 20 °C; 7 mmHg ( 140 °C)
• 荧光: λex 231 nm; λem 356 nm

安全信息

• 保存条件: Room Temperature (15-30°C)
• 保存注意事项: Hygroscopic; Irritant/Store under Argon
• RTECS编号: DV5775000
• 欧盟危险性物质标志: 环境危害性(Nature polluting) (N); 刺激性(Irritant) (Xi)
• 联合国危险货物编号: 3077; UN3077
• 德国WGK号: 2
• 联合国危险货物等级: 9
• 联合国危险货物包装类别(PG): 3; III
• 危险公开号: 36/37/38-50; R:36/38
• 安全公开号: 22-61; S:22
• TSCA收录: 是
• GHS危险品标识: GHS07; GHS09
• GHS警示词: Warning
• GHS危险声明: H315-H319-H335-H400; H400-H302-H315-H319-H335-H313
• GHS警示性声明: P261-P273-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves
• RID/ADR: UN 3077 9/PG 3

产品相关信息

• 纯度: ≥98.0% (GC); ≥99%; 97%; 98%; 99%
• 级别: analytical standard; PESTANAL®, analytical standard; purum
• 包装: ampule of 1000 mg
• 线性分子式: C6H5C6H4OH

详细说明

MP Biomedicals - 02195226

Crystalline
Inhibitor of deoxyribonuclease.

MP Biomedicals - 05203624

MP Biomedicals Rare Chemical collection

Sigma Aldrich - W395900

包装
1 kg in poly bottle
1 sample in glass bottle
5, 10 kg in fiber drum

Sigma Aldrich - P28263

包装
2 kg in poly bottle
500 g in poly bottle

Sigma Aldrich - 54890

Other Notes
用于丙糖荧光法测定的试剂1

Sigma Aldrich - 45529

法律信息
PESTANAL 注册商标 Sigma-Aldrich Laborchemikalien GmbH

参考文献

• Biochem. Biophys. Acta , 288 : 365, (1971).