4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl

Basic Information

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CAS Number

81998-04-1

Molecular Formula

C12H12N2O

Molecular Weight

200.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

119.0 to 123.0 deg-C

SMILES

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CC1=CC(=NC=C1)C2=NC=CC(=C2)CO

InChI

InChI=1S/C12H12N2O/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14-12/h2-7,15H,8H2,1H3

InChIKey

GJCOKGHYIMLMPB-UHFFFAOYSA-N

LogP

1.94432

Topological Polar Surface Area

46.010000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

198

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

(4'-Methyl-[2,2'-bipyridin]-4-yl)methanol
4-Hydroxymethyl-4'-methyl-2,2'-bipyridine 4'-Methyl-2,2'-bipyridine-4-methanol
4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl
[2-(4-methylpyridin-2-yl)pyridin-4-yl]methanol
4-Hydroxymethyl-4'-methyl-2,2'-bipyridine
4'-Methyl-2,2'-bipyridine-4-methanol
{4'-METHYL-[2,2'-BIPYRIDIN]-4-YL}METHANOL
BPDM05
AX8282357
(4-Methyl-[2,2-bipyridin]-4-yl)methanol
4-(HYDROXYMETHYL)-4'-METHYL-2,2'-BIPYRIDINE
AS-64553
H1347
SCHEMBL5468413
AKOS004909463
SY054918
MFCD02916382
81998-04-1
T72968
CS-0085998
DTXSID80373047
YSWG789
J-400604
4-(Hydroxymethyl)-4 inverted exclamation mark -methyl-2,2 inverted exclamation mark -bipyridine

MDL Number

MFCD02916382

FAQ

What are the physical and chemical properties of 4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl (CAS: 81998-04-1)?

4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl is a crystalline solid with a molecular weight of approximately 248.25 g/mol. It has limited water solubility and moderate solubility in common organic solvents. The compound has a basic nature and exhibits good stability under normal conditions. It is reactive towards electrophiles and bases, and is commonly used in chemical syntheses and as a ligand in coordination chemistry.

How is 4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl (CAS: 81998-04-1) typically synthesized?

4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl is typically synthesized through a condensation reaction of 4-hydroxymethylpyridine and 4-methylpyridine in the presence of an acid catalyst. The reaction yields a mixture of products, and the desired compound can be isolated and purified by recrystallization. The yield is generally around 70-80%, and the purity is typically 95-98%.

What industries use 4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl (CAS: 81998-04-1)?

4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl is used in various industries, including pharmaceuticals, where it serves as a ligand in coordination chemistry, and in the development of diagnostic reagents and sensors. It is also utilized in the synthesis of polymers and semiconductors, where its stability and reactivity make it a valuable compound.

What precautions should be taken when handling 4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl (CAS: 81998-04-1)?

When handling 4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl, wear appropriate personal protective equipment (PPE) including gloves and safety goggles. Store the compound in a closed container away from heat and direct sunlight. Use a fume hood during manipulation to avoid inhalation. In case of spill, use appropriate spill clean-up materials and wash the area with water. Refer to the Safety Data Sheet (SDS) for detailed emergency procedures and storage information.