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ChemicalBook--->CAS DataBase List--->591-31-1

591-31-1

591-31-1 Structure

591-31-1 Structure
IdentificationMore
[Name]

3-Methoxybenzaldehyde
[CAS]

591-31-1
[Synonyms]

3-ANISALDEHYDE
3-METHOXYBENZALDEHYDE
AKOS BBS-00003247
ANISALDEHYDE,3-
M-ANISALDEHYDE
META-ANISALDEHYDE
M-METHOXYBENZALDEHYDE
3-methoxybenzaldehde
3-methoxy-benzaldehyd
Metamethoxybenzaldehyde
META-ANISALDEHYD
m-Methoxybenzaldehyde 3-Methoxybenzaldehyde
M-ANISALDEHYDE 97+%
M-Anisaldehyde(3-MethoxyBenzaldehyde)
3-Methoxybenzaldehyde, 98% (3-Anisaldehyd)
3-Methoxybenzaldehyde,98%
Benzaldehyde, 3-methoxy-
3-methoxybenxaldehyde
3-METHOXYBENZALDEHYDE/M-ANISADEHYDE
3-METHOXYBENZALDEHYDE, 98.5%
[EINECS(EC#)]

209-712-8
[Molecular Formula]

C8H8O2
[MDL Number]

MFCD00003361
[Molecular Weight]

136.15
[MOL File]

591-31-1.mol
Chemical PropertiesBack Directory
[Appearance]

clear pale yellow to yellow liquid
[Melting point ]

187 °C
[Boiling point ]

143 °C50 mm Hg(lit.)
[density ]

1.117 g/mL at 20 °C(lit.)
[vapor pressure ]

1.3 hPa (73 °C)
[refractive index ]

n20/D 1.553(lit.)
[Fp ]

>230 °F
[storage temp. ]

Store below +30°C.
[solubility ]

Chloroform, Methanol (Slightly)
[form ]

Liquid
[color ]

Clear pale yellow to yellow
[Specific Gravity]

1.118
[Odor]

at 100.00?%. anisic
[Water Solubility ]

insoluble
[Sensitive ]

Air Sensitive
[BRN ]

606013
[LogP]

1.710
[CAS DataBase Reference]

591-31-1(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzaldehyde, 3-methoxy-(591-31-1)
[EPA Substance Registry System]

591-31-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R36/38:Irritating to eyes and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[RTECS ]

BZ2605000
[F ]

9-23
[Autoignition Temperature]

225 °C
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HazardClass ]

IRRITANT
[HS Code ]

29124900
[Toxicity]

sce-hmn:lyms 1 mmol/L MUREAV 206,17,88
Raw materials And Preparation ProductsBack Directory
[Raw materials]

3-Hydroxybenzaldehyde
[Preparation Products]

1,1'-SPIROBIINDANE-7,7'-DIOL-->7-Methoxycoumarin-->3-(3-METHOXYPHENYL)PROPIONIC ACID-->3-METHOXY-N-METHYLBENZYLAMINE 97-->3-Methoxycinnamic acid-->3-Methylanisole-->Phenylephrine-->2-Bromo-5-methoxybenzaldehyde-->3-Methoxybenzylamine-->3-METHOXY-4-NITROBENZALDEHYDE-->3-Methoxybenzyl chloride-->5,10,15,20-tetra(3-hydroxyphenyl)porphyrin-->3'-METHOXY-2,2,2-TRIFLUOROACETOPHENONE-->3-METHOXY-4-METHYLBENZALDEHYDE-->3-Methoxy-2-nitrobenzaldehyde
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

m-Anisaldehyde(591-31-1).msds
Hazard InformationBack Directory
[Chemical Properties]

clear pale yellow to yellow liquid
[Uses]

3-Methoxybenzaldehyde is used to prepare 3-(3-methoxy-phenyl)-1-phenyl-propenone by reaction with benzldehyde. It is used as an eluent for mono-13C isotopomers of vanillin in normal phase silica gel chromatography. It acts as an inhibitor of 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK) metabolism.
[Definition]

ChEBI: 3-methoxybenzaldehyde is a member of the class of benzaldehydes in which the hydrogen at position 3 of benzaldehyde has been replaced by a methoxy group. It has a role as a Brassica napus metabolite. It is a member of benzaldehydes and a monomethoxybenzene.
[Synthesis Reference(s)]

Synthetic Communications, 24, p. 2011, 1994 DOI: 10.1080/00397919408010209
[General Description]

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

Mutation data reported. Whenheated to decomposition it emits acrid smoke andirritating vapors.
[Purification Methods]

Wash it with saturated aqueous NaHCO3, then H2O, dry it with anhydrous MgSO4 and distil it under reduced pressure under N2. Store it under N2 in sealed glass ampoules. [Beilstein 8 IV 241.]
Spectrum DetailBack Directory
[Spectrum Detail]

3-Methoxybenzaldehyde(591-31-1)MS
3-Methoxybenzaldehyde(591-31-1)1HNMR
3-Methoxybenzaldehyde(591-31-1)13CNMR
3-Methoxybenzaldehyde(591-31-1)IR1
3-Methoxybenzaldehyde(591-31-1)IR2
3-Methoxybenzaldehyde(591-31-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

m-Anisaldehyde, 97%(591-31-1)
[Alfa Aesar]

3-Methoxybenzaldehyde, 98%(591-31-1)
[Sigma Aldrich]

591-31-1(sigmaaldrich)
[TCI AMERICA]

m-Anisaldehyde,>98.0%(GC)(591-31-1)
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