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Propionic acid, beta-(beta-isodurylyl)- structure
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Propionic acid, beta-(beta-isodurylyl)-

TL;DR: Propionic acid, beta-(beta-isodurylyl)- (CAS 63815-32-7) is a chemical compound with molecular formula C13H16O3 and molecular weight 220.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-methyl-3-oxo-3-(2,4,6-trimethylphenyl)propanoic acid

Also Known As: Propionic acid, beta-(beta-isodurylyl)-, 2-methyl-3-oxo-3-(2,4,6-trimethylphenyl)propanoic acid, 3-(2,4,6-Trimethoxybenzoyl)propionic acid, 2,2'-hexanediyldioxy-di-benzaldehyde, alpha,2,4,6-Tetramethyl-beta-oxobenzenepropionic acid

CAS Number
63815-32-7
Molecular Formula
C13H16O3
Molecular Weight
220.10994 g/mol
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Technical Specifications

Molecular FormulaC13H16O3
Molecular Weight220.10994 g/mol
XLogP3.0
Topological Polar Surface Area (TPSA)54.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds3
Exact Mass220.10994 Da
Heavy Atoms16
Complexity273.0
SMILESCC1=CC(=C(C(=C1)C)C(=O)C(C)C(=O)O)C
InChIKeyBNXYGYJTTAFHEE-UHFFFAOYSA-N

Chemical Property Profile of Propionic acid, beta-(beta-isodurylyl)-

XLogP
3.0
TPSA (Topological Polar Surface Area)
54.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
16
Complexity
273.0
Exact Mass
220.10994
Monoisotopic Mass
220.10994
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Propionic acid, beta-(beta-isodurylyl)-

The XLogP value of 3.0 indicates that Propionic acid, beta-(beta-isodurylyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Propionic acid, beta-(beta-isodurylyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propionic acid, beta-(beta-isodurylyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Propionic acid, beta-(beta-isodurylyl)-?

The CAS number of Propionic acid, beta-(beta-isodurylyl)- is 63815-32-7.

What is the molecular formula of Propionic acid, beta-(beta-isodurylyl)-?

The molecular formula of Propionic acid, beta-(beta-isodurylyl)- is C13H16O3.

What is the molecular weight of Propionic acid, beta-(beta-isodurylyl)-?

The molecular weight of Propionic acid, beta-(beta-isodurylyl)- is 220.10994 g/mol.

Where can I buy Propionic acid, beta-(beta-isodurylyl)-?

You can request a quote for Propionic acid, beta-(beta-isodurylyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Propionic acid, beta-(beta-isodurylyl)-?

Yes, CoreyChem provides custom synthesis services for Propionic acid, beta-(beta-isodurylyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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