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129658

m-Anisaldehyde

Name: <I>m</I>-Anisaldehyde
Brand: ALDRICH

97%

Synonym(s):

3-Methoxybenzaldehyde

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About This Item

Linear Formula:

CH₃OC₆H₄CHO

CAS Number:

591-31-1

Molecular Weight:

136.15

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24847920

EC Number:

209-712-8

Beilstein/REAXYS Number:

606013

MDL number:

MFCD00003361

Assay:

97%

Form:

liquid

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Properties

Quality Level

200

assay

97%

form

liquid

refractive index

n20/D 1.553 (lit.)

bp

143 °C/50 mmHg (lit.)

density

1.117 g/mL at 20 °C (lit.)

functional group

aldehyde

SMILES string

[H]C(=O)c1cccc(OC)c1

InChI

1S/C8H8O2/c1-10-8-4-2-3-7(5-8)6-9/h2-6H,1H3

InChI key

WMPDAIZRQDCGFH-UHFFFAOYSA-N

Description

General description

m-Anisaldehyde has significant antifungal activity against Candida sp., including the azole-resistant strains.

m-Anisaldehyde is a class of benzaldehyde, used as a potent antifungal agent and as the starting material for complex aromatic compounds.

Application

m-Anisaldehyde was used as an eluent for mono-¹³C isotopomers of vanillin in normal phase silica gel chromatography. It was also used as an inhibitor of 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK) metabolism.

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pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

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Structural and spectroscopic (UV--Vis, IR, Raman, and NMR) characteristics of anisaldehydes that are flavoring food additives: A density functional study in comparison with experiments

Altun, et al.

Journal of Molecular Structure, 1128, 590-605 (2017)

Inhibition of metabolism of 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone by dietary benzaldehydes.

M A Morse et al.

Cancer letters, 97(2), 255-261 (1995-11-06)

As part of a routine screening assay, benzaldehyde was found to inhibit 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK) metabolism. Consequently, the effects of benzaldehyde and several structurally related compounds on NNK metabolism were examined in murine hepatic and pulmonary microsomes. All test compounds inhibited

Retention of sparingly soluble volatile compounds during the freeze drying of model solutions

Smyrl,et al.

Journal of Food Process Engineering, 2, 151-170 (1978)

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Global Trade Item Number

SKU	GTIN
129658-100G	04061838726421
129658-25G	04061838726438