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199206

4-甲氧基苯乙酸甲酯

97%

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关于此项目

线性分子式:
CH3OC6H4CH2CO2CH3
化学文摘社编号:
23786-14-3
分子量:
180.20
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24851898
EC Number:
245-886-1
Beilstein/REAXYS Number:
2209665
MDL number:
MFCD00008454
Assay:
97%
Form:
liquid
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Quality Level

100

assay

97%

form

liquid

refractive index

n20/D 1.516 (lit.)

bp

158 °C/19 mmHg (lit.)

density

1.135 g/mL at 25 °C (lit.)

functional group

ester

SMILES string

COC(=O)Cc1ccc(OC)cc1

InChI

1S/C10H12O3/c1-12-9-5-3-8(4-6-9)7-10(11)13-2/h3-6H,7H2,1-2H3

InChI key

ZQYLDVNTWDEAJI-UHFFFAOYSA-N

Application

Methyl 4-methoxyphenylacetate was used in the synthesis of 7,8-dihydroxy-2-(4′-hydroxybenzyl)-4H-1-benzopyran-4-one.

pictograms

Flame
GHS02

signalword

Warning

hcodes

H226

Hazard Classifications

Flam. Liq. 3

存储类别

3 - Flammable liquids

wgk

WGK 3

flash_point_f

96.8 °F - closed cup

flash_point_c

36 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

法规信息

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分析证书(COA)

Lot/Batch Number
MKCQ9352
MKCL8050
MKBZ0149V
MKBW1716V
MKBS8141V

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Giulio Rastelli et al.
Bioorganic & medicinal chemistry, 10(5), 1427-1436 (2002-03-12)
The relative binding affinities to human aldose reductase (ALR2) of three new 7-hydroxy-2-benzyl-4H-1-benzopyran-4-one inhibitors were predicted by free energy perturbation (FEP) simulations. Molecular substitutions were specifically designed to investigate the role of hydrogen bonding at the active site of ALR2.

全球贸易项目编号

货号GTIN
199206-25G04061838763068