4-甲酰基苯硼酸
TL;DR: 4-甲酰基苯硼酸 (CAS 455-84-5) is a chemical compound with molecular formula C7H7BO3 and molecular weight 150.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲酰基苯硼酸
(4-formylphenyl)boronic acid
Also Known As: 4-Formylphenylboronic acid, (4-formylphenyl)boronic acid, 4-Formylbenzeneboronic acid, 4-Boronobenzaldehyde, 4-Formylphenylboronicacid
| Molecular Formula | C7H7BO3 |
|---|---|
| Molecular Weight | 150.05 g/mol |
| LogP | -0.8211 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.04883 |
| Heavy Atoms | 11 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 455-84-5 |
|---|---|
| SMILES | B(C1=CC=C(C=C1)C=O)(O)O |
| InChIKey | VXWBQOJISHAKKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-甲酰基苯硼酸 (CAS 455-84-5), with molecular formula C7H7BO3 and molecular weight 150.05 g/mol. IUPAC: (4-formylphenyl)boronic acid.
Chemical Property Profile of 4-甲酰基苯硼酸
Property Insights of 4-甲酰基苯硼酸
The XLogP value of -0.8211 indicates that 4-甲酰基苯硼酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.5 Ų, 4-甲酰基苯硼酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-甲酰基苯硼酸 has 2 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 4-甲酰基苯硼酸?
The CAS number of 4-甲酰基苯硼酸 is 455-84-5.
What is the molecular formula of 4-甲酰基苯硼酸?
The molecular formula of 4-甲酰基苯硼酸 is C7H7BO3.
What is the molecular weight of 4-甲酰基苯硼酸?
The molecular weight of 4-甲酰基苯硼酸 is 150.05 g/mol.
Where can I buy 4-甲酰基苯硼酸?
You can request a quote for 4-甲酰基苯硼酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲酰基苯硼酸?
Yes, KEHONG BIO provides custom synthesis services for 4-甲酰基苯硼酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.