CAS: 39668-86-5
名称: 5-methyl-2-propan-2-ylcyclohexane-1-carboxylic acid
SMILES:
CC1CCC(C(C1)C(=O)O)C(C)C分子加工
分子式
C11H20O2
分子量
184.28
精确质量
184.1463
XLogP
2.78
TPSA
37.3
氢键给体数
1
氢键受体数
1
可旋转键
2
重原子数
13
环数
1
芳香环
0
饱和环
1
脂环
1
立体中心
3
未定义立体
3
形式电荷
0
杂原子数
2
共价单元
1
sp3占比
0.909
摩尔折射率
52.47
补充信息
InChIKey: MNVSUVYRIVXDBK-UHFFFAOYSA-N
同义词
39668-86-5p-Menthane-3-carboxylic acidEINECS 254-582-8Cyclohexanecarboxylic acid, 5-methyl-2-(1-methylethyl)-AI3-32584NSC 55371RefChem:169350254-582-82-isopropyl-5-methyl-cyclohexanecarboxylic acid2-isopropyl-5-methylcyclohexanecarboxylic acid5-methyl-2-(propan-2-yl)cyclohexane-1-carboxylic acid5-methyl-2-propan-2-ylcyclohexane-1-carboxylic acid(1S,2R,5S)-2-Isopropyl-5-methylcyclohexanecarboxylic acid62309-29-9NSC55371MFCD09033790menthane carboxylic acidMenthane-3-carboxylic acidSCHEMBL4648505-Methyl-2-(1-methylethyl)cyclohexanecarboxylic acidSCHEMBL4815133SCHEMBL15226024DTXSID30864657NSC-55371AKOS010488646SB34015SB47697DB-2820522-isopropyl-5-methylcyclohexanecarboxylicacidCS-0243749
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