Methanol, oxo-, benzoate
TL;DR: Methanol, oxo-, benzoate (CAS 78823-32-2) is a chemical compound with molecular formula C8H6O3 and molecular weight 150.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
formyl benzoate
Also Known As: Benzoylformate, formyl benzoate, Benzoyl formate, benzoic formic anhydride, Methanol, oxo-, benzoate
| Molecular Formula | C8H6O3 |
|---|---|
| Molecular Weight | 150.03 g/mol |
| LogP | 0.9998 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.0317 |
| Heavy Atoms | 11 |
| Complexity | 253.2995 |
Chemical Identifiers
| CAS Number | 78823-32-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC=O |
Product Overview
Methanol, oxo-, benzoate (CAS 78823-32-2), with molecular formula C8H6O3 and molecular weight 150.03 g/mol. IUPAC: formyl benzoate.
Chemical Property Profile of Methanol, oxo-, benzoate
Property Insights of Methanol, oxo-, benzoate
The XLogP value of 0.9998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanol, oxo-, benzoate. With a topological polar surface area (TPSA) of 43.37 Ų, Methanol, oxo-, benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanol, oxo-, benzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methanol, oxo-, benzoate?
The CAS number of Methanol, oxo-, benzoate is 78823-32-2.
What is the molecular formula of Methanol, oxo-, benzoate?
The molecular formula of Methanol, oxo-, benzoate is C8H6O3.
What is the molecular weight of Methanol, oxo-, benzoate?
The molecular weight of Methanol, oxo-, benzoate is 150.03 g/mol.
Where can I buy Methanol, oxo-, benzoate?
You can request a quote for Methanol, oxo-, benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanol, oxo-, benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methanol, oxo-, benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.