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名称

3-(2-甲氧基苯基）丙酸

分子类型

小分子

别名

2-甲氧基氢化肉桂酸

英文别名

2,5-oxazolidinedione, 4-(1-methylethyl)- | XSZSNLOPIWWFHS-UHFFFAOYSA- | STK501177 | NCGC00188251-01 | NSC46646 | NSC-46646 | AMY4066 | EN300-17488 | SY014884 | BS-3975 | InChI=1/C10H12O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12) | AB00262

英文名称

3-(2-Methoxyphenyl)propionic acid

货号

W137316-10g

包装规格

10g

浓度

≥98%

运输条件

常规运输

CAS号

6342-77-4

分子式

CH3OC6H4CH2CH2CO2H

分子量

180.2 g/mol

Beilstein号

2097012

EC号

228-738-0

MDL号

MFCD00002772

PubChem编号

80652

Isomeric SMILES

COC1=CC=CC=C1CCC(=O)O

IIUPAC Name

3-(2-methoxyphenyl)propanoic acid

INCHI

1S/C10H12O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)

InChi Key

XSZSNLOPIWWFHS-UHFFFAOYSA-N

Smiles

COC1=CC=CC=C1CCC(=O)O

PubChem CID

80652

PubChem SID

488185894

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

180.079 Da

单同位素质量Monoisotopic Mass

180.079 Da

拓扑极表面积Topological Polar Surface Area

46.500 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

168

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

2.1

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

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「No related articles yet」

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