CAS 2612-30-8

2-benzylpropane-1,3-diol

Description:

2-Benzylpropane-1,3-diol, with the CAS number 2612-30-8, is an organic compound characterized by its structure, which features a propane backbone with hydroxyl (–OH) groups at the first and third carbon positions, and a benzyl group attached to the second carbon. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in water and various organic solvents, making it versatile for different applications. The presence of hydroxyl groups contributes to its potential as a humectant and moisturizer in cosmetic formulations, while the benzyl group can enhance its aromatic properties. Additionally, 2-benzylpropane-1,3-diol may exhibit antimicrobial and antioxidant activities, which can be beneficial in pharmaceutical and personal care products. Its chemical stability and reactivity can be influenced by the functional groups present, allowing for various chemical modifications. Safety data should be consulted for handling and usage, as with any chemical substance.

Formula: C₁₀H₁₄O₂

InChI: InChI=1/C10H14O2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2

SMILES: c1ccc(cc1)CC(CO)CO

Synonyms:

• 1,3-Propanediol, 2-(Phenylmethyl)-
• 2-Benzyl-1,3-propanediol
• 2-Benzylpropane-1,3-diol

1,3-Propanediol, 2-(phenylmethyl)-

CAS: 2612-30-8

Formula: C₁₀H₁₄O₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 166.2170

Ref: IN-DA002RS1

2-Benzyl-1,3-propanediol

Controlled Product

CAS: 2612-30-8

Formula: C₁₀H₁₄O₂

Color and Shape: Neat

Molecular weight: 166.22

Ref: TR-B288795

2-Benzyl-1,3-propanediol

CAS: 2612-30-8

Purity: 95%

Molecular weight: 166.2200012

Ref: 10-F789329

2-Benzylpropane-1,3-diol

CAS: 2612-30-8

2-Benzylpropane-1,3-diol is an intermediate in the synthesis of desymmetrization. It can be used to synthesize β-amino acids by acetylation and chemoenzymatic methods. The binding constants for 2-benzylpropane-1,3-diol with porcine pancreatic lipase were determined using a kinetic study. A molecular modeling study was conducted to gain insight into the binding properties of 2-benzylpropane-1,3-diol with porcine pancreatic lipase. The molecular modeling study revealed that 2-benzylpropane-1,3-diol binds to the active site of porcine pancreatic lipase and stabilizes the enzyme's structure.

Formula: C₁₀H₁₄O₂

Purity: Min. 95%

Molecular weight: 166.22 g/mol

Ref: 3D-CAA61230