Bromomethyl acetate
TL;DR: Bromomethyl acetate (CAS 590-97-6) is a chemical compound with molecular formula C3H5BrO2 and molecular weight 151.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bromomethyl acetate
Also Known As: Bromomethyl acetate, Bromomethanol acetate, brommethylacetat, Bromomethylacetate, stearylmethacrylate
| Molecular Formula | C3H5BrO2 |
|---|---|
| Molecular Weight | 151.95 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 151.9473 |
| Heavy Atoms | 6 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 590-97-6 |
|---|---|
| SMILES | CC(=O)OCBr |
| InChIKey | NHYXMAKLBXBVEO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bromomethyl acetate (CAS 590-97-6), with molecular formula C3H5BrO2 and molecular weight 151.95 g/mol. IUPAC: bromomethyl acetate.
Chemical Property Profile of Bromomethyl acetate
Property Insights of Bromomethyl acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromomethyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Bromomethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bromomethyl acetate has 0 hydrogen bond donor(s) and 2 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 Bromomethyl acetate?
The CAS number of Bromomethyl acetate is 590-97-6.
What is the molecular formula of Bromomethyl acetate?
The molecular formula of Bromomethyl acetate is C3H5BrO2.
What is the molecular weight of Bromomethyl acetate?
The molecular weight of Bromomethyl acetate is 151.95 g/mol.
Where can I buy Bromomethyl acetate?
You can request a quote for Bromomethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromomethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Bromomethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.