4-(羟甲基)苯甲酸
TL;DR: 4-(羟甲基)苯甲酸 (CAS 3006-96-0) is a chemical compound with molecular formula C8H8O3 and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(羟甲基)苯甲酸
4-(hydroxymethyl)benzoic acid
Also Known As: 4-(Hydroxymethyl)benzoic acid, hmba, HMBA Linker, 4-HYDROXYMETHYLBENZOIC ACID, HMP linker
| Molecular Formula | C8H8O3 |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.04735 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 3006-96-0 |
|---|---|
| SMILES | C1=CC(=CC=C1CO)C(=O)O |
| InChIKey | WWYFPDXEIFBNKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(羟甲基)苯甲酸 (CAS 3006-96-0), with molecular formula C8H8O3 and molecular weight 152.05 g/mol. IUPAC: 4-(hydroxymethyl)benzoic acid.
Chemical Property Profile of 4-(羟甲基)苯甲酸
Property Insights of 4-(羟甲基)苯甲酸
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(羟甲基)苯甲酸. With a topological polar surface area (TPSA) of 57.5 Ų, 4-(羟甲基)苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(羟甲基)苯甲酸 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-(羟甲基)苯甲酸?
The CAS number of 4-(羟甲基)苯甲酸 is 3006-96-0.
What is the molecular formula of 4-(羟甲基)苯甲酸?
The molecular formula of 4-(羟甲基)苯甲酸 is C8H8O3.
What is the molecular weight of 4-(羟甲基)苯甲酸?
The molecular weight of 4-(羟甲基)苯甲酸 is 152.05 g/mol.
Where can I buy 4-(羟甲基)苯甲酸?
You can request a quote for 4-(羟甲基)苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(羟甲基)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(羟甲基)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.