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626-51-7

626-51-7 Structure

626-51-7 Structure
IdentificationMore
[Name]

3-METHYLGLUTARIC ACID
[CAS]

626-51-7
[Synonyms]

3-METHYLGLUTARIC ACID
3-METHYLPENTANEDIOIC ACID
B-METHYLGLUTARIC ACID
beta-Methylglutaric acid
Pentanedioic acid, 3-methyl-
3-Methylglutaricacid,99%
[EINECS(EC#)]

210-951-5
[Molecular Formula]

C6H10O4
[MDL Number]

MFCD00002727
[Molecular Weight]

146.14
[MOL File]

626-51-7.mol
Chemical PropertiesBack Directory
[Appearance]

WHITE FINE CRYSTALLINE POWDER
[Melting point ]

81-86 °C(lit.)
[Boiling point ]

311.39°C (rough estimate)
[density ]

1.4528 (rough estimate)
[refractive index ]

1.4336 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly, Sonicated), DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

4.24(at 25℃)
[color ]

White to Off-White
[Water Solubility ]

Soluble in water, and ethanol.
[BRN ]

1759502
[InChI]

InChI=1S/C6H10O4/c1-4(2-5(7)8)3-6(9)10/h4H,2-3H2,1H3,(H,7,8)(H,9,10)
[InChIKey]

XJMMNTGIMDZPMU-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CC(C)CC(O)=O
[CAS DataBase Reference]

626-51-7(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system 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 .
[WGK Germany ]

3
[HS Code ]

29171900
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Ethyl acetate-->Sulfuric acid-->Thionyl chloride-->Petroleum ether-->Sodium sulfate-->Potassium hydroxide-->Sodium chloride-->Benzene-->Ammonium chloride-->Sodium hydride-->Diethyl malonate-->Sodium bromide-->Vinylacetic acid-->2,4-Dicyano-3-methylglutaramide
[Preparation Products]

(1S,2S)-2-Methylcyclopropane-1-carboxylic acid
Hazard InformationBack Directory
[Chemical Properties]

WHITE FINE CRYSTALLINE POWDER
[Uses]

3-Methylglutaric Acid is used in preparation method of high-adhesion super weather-resistant powder coating.
[Definition]

ChEBI: An alpha,omega-dicarboxylic acid that is glutaric acid substituted at position 3 by a methyl group.
[IC 50]

Human Endogenous Metabolite
[Purification Methods]

Crystallise the acid from distilled water, then dry it under vacuum over conc H2SO4. [Beilstein 2 IV 1992.]
Spectrum DetailBack Directory
[Spectrum Detail]

3-METHYLGLUTARIC ACID(626-51-7)MS
3-METHYLGLUTARIC ACID(626-51-7)1HNMR
3-METHYLGLUTARIC ACID(626-51-7)13CNMR
3-METHYLGLUTARIC ACID(626-51-7)IR1
3-METHYLGLUTARIC ACID(626-51-7)IR2
3-METHYLGLUTARIC ACID(626-51-7)IR3
3-METHYLGLUTARIC ACID(626-51-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Methylglutaric acid, 99%(626-51-7)
[Alfa Aesar]

3-Methylglutaric acid, 99%(626-51-7)
[Sigma Aldrich]

626-51-7(sigmaaldrich)
[TCI AMERICA]

3-Methylglutaric Acid,>99.0%(T)(626-51-7)
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