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2-苯基异丁酸 | 826-55-1

2-苯基异丁酸
2-methyl-2-phenylpropanoic acid
826-55-1
C10H12O2
164.201083183289
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:2-苯基异丁酸结构式
13222
2-苯基异丁酸价格
名称和标识符
MDL MFCD00014332
InChIKey YYEROYLAYAVZNW-UHFFFAOYSA-N
Inchi 1S/C10H12O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)
SMILES O=C(C(C)(C)C1C=CC=CC=1)O
BRN 1817837
别名信息
- 中文别名 -
  • 2-苯基异丁酸
  • a,a-二甲基苯乙酸
  • 2,2-二甲基苯乙酸
  • 2-Phenylisobutyric Acid 2-苯基异丁酸
  • 2-甲基-2-苯基丙酸
  • alpha,alpha-二甲基苯乙酸
  • α,α-二甲基苯乙酸
  • alph,alph-二甲基苯乙酸
- 英文别名 -
  • 2-Methyl-2-phenylpropionic acid
  • 2-Phenylisobutyric acid
  • alpha,alpha-Dimethyl phenyl Acetic Acid
  • 2,2-DIMETHYLPHENYLACETIC ACID
  • 2-methyl-2-phenylpropanoic acid
  • ^a,^a-DiMethylphenylacetic acid
  • alpha,alpha-Dimethylphenylacetic acid
  • Dimethylphenylacetic acid
  • DR8HUH2GYK
  • 2-phenyl-2-methylpropionic acid
  • 2-methyl-2-phenyl-propionic acid
  • Hydratropic acid, .alpha.-methyl-
  • Propionic acid, 2-methyl-2-phenyl-
  • Benzeneacetic acid,.alpha.-dimethyl-
  • TH 4161
  • .alpha.-Toluic acid,.alpha.-dimethyl-
  • .alpha.,.alpha.-Dimethylphenylacetic acid
  • .alpha.,.alpha.-Dimethylbenzeneacetic acid
  • Phenylisob
  • 2-Methyl-2-phenylpropionic Acid
  • Hydratropic acid, α-methyl- (6CI, 7CI, 8CI)
  • α,α-Dimethylbenzeneacetic acid (ACI)
  • 2,2-Dimethyl-2-phenylacetic acid
  • 2-Methyl-2-phenylpropanoic acid
  • 2-Phenyl-2-methylpropionic acid
  • 2-Phenylisobutanoic acid
  • NSC 28952
  • NSC 29095
  • α,α-Dimethylphenylacetic acid
  • AM20041211
  • 2,2-DIMETHYL-2-PHENYLACETIC ACID
  • NSC-28952
  • AKOS000121417
  • SY001281
  • NSC29095
  • alpha, alpha-dimethylphenylacetic acid
  • NS00008935
  • P1409
  • alpha,alpha-DIMETHYLPHENYLACETIC ACID
  • UNII-DR8HUH2GYK
  • Benzeneacetic acid, .alpha.,.alpha.-dimethyl-
  • 2-Methyl-2-phenylpropanoic acid, AldrichCPR
  • 2-Methyl-2-phenylpropanoic acid, AldrichCPR
  • A,A-Dimethylbenzeneacetic acid
  • A,A-Dimethylbenzeneacetic acid
  • 2-methyl-2-phenyl propanoic acid
  • 2-methyl-2-phenyl propanoic acid
  • NSC28952
  • NSC28952
  • MFCD00014332
  • MFCD00014332
  • alpha,alpha-dimethylbenzeneacetic acid
  • alpha,alpha-dimethylbenzeneacetic acid
  • Q27276560
  • Q27276560
  • 2-Methyl-2-phenylpropionicacid
  • 2-Methyl-2-phenylpropionicacid
  • alpha , alpha -Dimethylphenylacetic acid
  • alpha , alpha -Dimethylphenylacetic acid
  • AS-10791
  • AS-10791
  • AE-562/43450611
  • AE-562/43450611
  • 826-55-1
  • 826-55-1
  • 2-methyl-2-phenyl- propionic acid
  • 2-methyl-2-phenyl- propionic acid
  • InChI=1/C10H12O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)
  • InChI=1/C10H12O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)
  • 2,2-dimethyl-2-phenyl-acetic acid
  • 2,2-dimethyl-2-phenyl-acetic acid
  • phenylisobutyric acid
  • phenylisobutyric acid
  • W-104168
  • W-104168
  • EC 212-556-3
  • EC 212-556-3
  • L10018
  • L10018
  • YYEROYLAYAVZNW-UHFFFAOYSA-
  • YYEROYLAYAVZNW-UHFFFAOYSA-
  • NSC-29095
  • NSC-29095
  • Z104493600
  • Z104493600
  • EN300-21181
  • EN300-21181
  • DTXSID90231907
  • DTXSID90231907
  • SCHEMBL6571
  • SCHEMBL6571
  • CS-W004146
  • CS-W004146
  • FT-0622096
  • FT-0622096
  • Phenylisobuttersaure
  • Phenylisobuttersaure
  • AC-370
  • AC-370
  • EINECS 212-556-3
  • EINECS 212-556-3
  • YYEROYLAYAVZNW-UHFFFAOYSA-N
  • YYEROYLAYAVZNW-UHFFFAOYSA-N
物化性质
实验特性
LogP 2.04880
PSA 37.30000
水溶性 Insoluble in water.
沸点 270.5℃ at 760 mmHg
熔点 77.0 to 81.0 deg-C
闪点 146.5℃
颜色与性状 白色结晶固体。
溶解性 未确定
密度 1.0890
计算特性
精确分子量 164.08400
氢键供体数量 1
氢键受体数量 2
可旋转化学键数量 2
同位素质量 164.084
重原子数量 12
复杂度 167
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 1.6
表面电荷 0
拓扑分子极性表面积 37.3
国际标准相关数据
EINECS 212-556-3
海关数据
海关编码 2942000000
海关数据

中国海关编码:

2916399090

概述:

2916399090 其他芳香一元羧酸. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%

申报要素:

品名, 成分含量, 用途, 丙烯酸、丙烯酸盐或酯应报明包装

Summary:

2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

相关文献
专业数据库参考
PubChemId 13222
参考资料
Reaxys RN 1817837
Beilstein 9(4)1832
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