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名称

3-环己基丙酸

分子类型

小分子

别名

环己基丙酸 | 菠萝酸 | 环己烷丙酸

英文别名

FT-0615570 | H10698 | CXP | Q27093281 | AMY3571 | Cyclohexanepropanoic acid | NSC 404945 | BCP30878 | EN300-20695 | F2191-0095 | 3-Cyclohexanepropionic acid | 3-cyclohexyl propionic acid | 3-cyclohexanepropanoic acid | A866655 | DB02242 | Cyclohexanepropi

英文名称

3-Cyclohexanepropionic acid

货号

C106974-2.5L

包装规格

2.5L

浓度

≥99%

储存温度

2-8°C储存,避光,充氩

运输条件

冰袋运输

敏感性

对光、空气敏感

产品介绍

3-环己烷丙酸可用于：合成体外对氧磷酶-1（PON1）研究用2-[(1,2,4-三唑-3-基）硫代]乙酰胺衍生物的原料合成环己烷丙腈、环己烷丙酰胺、环己烷丙醇和1-氧杂螺[4.5]癸-2-酮[4]等化学中间体。 3-Cyclohexanepropionic acid can be used: • As a starting material in the synthesis of 2-[(1,2,4-triazol-3-yl)thio]acetamide derivatives for in vitro paraoxonase-1 (PON1) studies. • To synthesize chemical intermediates such as cyclohexanepropanenitrile cyclohexanepropanamide , cyclohexanepropanol, and 1-oxaspiro decan-2-one

生化机理

3-Cyclohexanepropionic acid 可通过跨膜/穿膜渗透促进大鼠口服色甘宁。

应用

3-Cyclohexanepropionic acid can be used: · As a starting material in the synthesis of 2-[(1,2,4-triazol-3-yl)thio]acetamide derivatives for in vitro paraoxonase-1 (PON1) studies. · To synthesize chemical intermediates such as cyclohexanepropanenitrile cyclohexanepropanamide , cyclohexanepropanol, and 1-oxaspiro decan-2-one

CAS号

701-97-3

分子式

C9H16O2

分子量

156.22 g/mol

Beilstein号

2042799

EC号

211-861-9

MDL号

MFCD00001527

PubChem编号

69702

Isomeric SMILES

C1CCC(CC1)CCC(=O)O

IIUPAC Name

3-cyclohexylpropanoic acid

INCHI

1S/C9H16O2/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,10,11)

InChi Key

HJZLEGIHUQOJBA-UHFFFAOYSA-N

Smiles

C1CCC(CC1)CCC(=O)O

PubChem SID

488184389

溶解性

Soluble in water 10g/ L.

熔点

14-17°C

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

156.115 Da

单同位素质量Monoisotopic Mass

156.115 Da

拓扑极表面积Topological Polar Surface Area

37.300 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

126.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

2.800

密度

折光率

1.464

闪点(℃)

130℃

沸点

275.7°C

Reaxy-Rn

2042799

凝固点

16 °C

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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