HCID86046

1-Methylcyclohex-3-ene-1-carboxylic acid

C8H12O2140.18 g/molCAS 16646-42-7

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IDENTITY

结构与身份

标准SMILES: CC1(C(=O)O)CC=CCC1
InChIKey: FKOPGCJIAFSDAO-UHFFFAOYSA-N
分子式: C8H12O2
平均分子量: 140.18 g/mol
单同位素质量: 140.08372962

COMPUTED

结构计算性质

等待补全

XLogP: 1.6
极性表面积: 37.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 1
重原子: 10
形式电荷: 0
复杂度: 172

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 28 条

1-methylcyclohex-3-ene-1-carboxylic acid1-Methyl-3-cyclohexene-1-carboxylic acidDTXSID90937199RefChem:434575DTXCID701365775983-185-916646-42-71-methylcyclohex-3-enecarboxylic acid3-Cyclohexene-1-carboxylic acid, 1-methyl-1-Methyl-3-cyclohexenecarboxylic acidMFCD017351941-METHYL-3-CYCLOHEXENECARBOXYLICACID1-Methyl-cyclohex-3-enecarboxylic acidBRN 06371363-Cyclohexene-1-carboxylicacid, 1-methyl-SCHEMBL911793-09-00-00163 (Beilstein Handbook Reference)AKOS006276833AC-37506AS-65519

REACTIONS