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114527-28-5

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114527-28-5 Structure

114527-28-5 Structure
IdentificationBack Directory
[Name]

4-Methyl-4'-(3-carboxypropyl)-2,2'-bipyridine
[CAS]

114527-28-5
[Synonyms]

4'-Methyl[2,2'-bipyridine]-4-butanoic acid
4-Methyl-4'-(3-carboxypropyl)-2,2'-bipyridine
4-(4'-Methyl-[2,2'-bipyridin]-4-yl)butanoic acid
[Molecular Formula]

C15H16N2O2
[MDL Number]

MFCD15144908
[MOL File]

114527-28-5.mol
[Molecular Weight]

256.3
Chemical PropertiesBack Directory
[Melting point ]

107-109 °C
[Boiling point ]

447.4±40.0 °C(Predicted)
[density ]

1.176±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[pka]

4.58±0.10(Predicted)
[InChI]

InChI=1S/C15H16N2O2/c1-11-5-7-16-13(9-11)14-10-12(6-8-17-14)3-2-4-15(18)19/h5-10H,2-4H2,1H3,(H,18,19)
[InChIKey]

LFMPLEMXVCGLMX-UHFFFAOYSA-N
[SMILES]

C1(C2=NC=CC(C)=C2)=NC=CC(CCCC(O)=O)=C1
[CAS DataBase Reference]

114527-28-5
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

4-Methyl-4'-(3-carboxypropyl)-2,2'-bipyridine(114527-28-5)1HNMR
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