99799-09-4 (4-羟基环己基乙酸,2-(4-Hydroxycyclohexyl)acetic acid)

CAS号:
99799-09-4
中文名称:
4-羟基环己基乙酸
英文名称:
2-(4-Hydroxycyclohexyl)acetic acid
分子式:
C8H14O3
分子量:
158.194962978363

4-羟基环己基乙酸(99799-09-4)名称与标识符

名称

中文别名:
4-羟基环己基乙酸;
英文别名:
2-(4-Hydroxycyclohexyl)acetic acid;4-hydroxy-Cyclohexane acetic acid;4-Hydroxycyclohexylacetic acid;Cyclohexaneacetic acid,4-hydroxy-;4-Hydroxycyclohexylessigsaeure;trans-2-(4-Hydroxycyclohexyl)acetic acid;cis-2-(4-Hydroxycyclohexyl)acetic acid;cis-4-Hydroxycyclohexylacetic acid;trans-4-Hydroxycyclohexylacetic acid;2-(Cis-4-hydroxycyclohexyl)acetic acid;(4-Hydroxycyclohexyl)acetic acid;Cyclohexaneacetic acid, 4-hydroxy-;(4-hydroxy-cyclohexyl)-acetic acid;Cyclohexaneacetic acid, 4-hydroxy-, trans-;4-hydroxy-Cyclohexaneacetic acid;4-Hydroxycyclohexylacetate;cis;ALTAAUJNHYWOGS-UHFFFAOYSA-N;AKOS015855457;ALTAAUJNHYWOGS-KNVOCYPGSA-N;DTXSID80988271;AKOS015855458;2-(trans-4-Hydroxycyclohexyl)acetic Acid;Q27161530;68592-22-3;2-(Cis-4-hydroxycyclohexyl)aceticacid;FT-0660293;2-[(1s,4s)-4-hydroxycyclohexyl]acetic acid;Rel-2-((1r,4r)-4-hydroxycyclohexyl)acetic acid;SCHEMBL338555;(4-hydroxycyclo-hexyl)ethanoic acid;CHEBI:88508;SCHEMBL2255221;4-hydroxy-cyclohexyl Acetic acid ester;cis-4-Hydroxycyclohexylacetate;68592-23-4;4-Hydroxy-cyclohexylessigsaeure;cis-4-hydroxycyclohexane acetic cid;CHEBI:89344;SY325448;SY319932;DS-7458;SY114095;MFCD16661181;99799-09-4;MFCD16661175;SCHEMBL1861522;F2147-4251;(4-hydroxycyclohexyl)ethanoic acid;AKOS022173422;CS-W021411;A1-01900;Q27160395;SB84531;(cis-4-hydroxycyclohexyl)acetic acid;H1753;F86836;MFCD13659403;cis-4-hydroxycyclohexane acetic acid;trans-4-Hydroxycyclohexylacetate;4-Hydroxycyclohexaneacetic Acid; (4-Hydroxy-cyclohexyl)-acetic Acid;cis-4-Hydroxycyclohexaneacetic acid;DB-349367;inverted exclamation markY98%(GC)(T);2-(4-hydroxycyclohexyl)acetate;A11165;

标识符

MDL:
MFCD13659403
InChIKey:
ALTAAUJNHYWOGS-UHFFFAOYSA-N
Inchi:
1S/C8H14O3/c9-7-3-1-6(2-4-7)5-8(10)11/h6-7,9H,1-5H2,(H,10,11)
SMILES:
OC1CCC(CC(=O)O)CC1

4-羟基环己基乙酸(99799-09-4)物化性质

实验特性

  • LogP : 1.01220
  • PSA : 57.53000

计算特性

  • 精确分子量 : 158.09400
  • 氢键供体数量 : 2
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 2
  • 同位素质量 : 158.094294304g/mol
  • 重原子数量 : 11
  • 复杂度 : 136
  • 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) : 0.6
  • 拓扑分子极性表面积 : 57.5

4-羟基环己基乙酸(99799-09-4)海关数据

海关编码:
2918199090
海关数据:

中国海关编码:

2918199090

概述:

HS: 2918199090. 其他含醇基但不含其他含氧基羧酸(包括其酸酐、酰卤化物、过氧化物和过氧酸及该税号的衍生物). 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

Summary:

2918199090 other carboxylic acids with alcohol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%