1-Propanone, 1-(3-bromophenyl)-
TL;DR: 1-Propanone, 1-(3-bromophenyl)- (CAS 19829-31-3) is a chemical compound with molecular formula C9H9BrO and molecular weight 211.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromophenyl)propan-1-one
Also Known As: 3'-Bromopropiophenone, 1-(3-bromophenyl)propan-1-one, 3-Bromopropiophenone, 1-Propanone, 1-(3-bromophenyl)-, m-Bromopropiophenone
| Molecular Formula | C9H9BrO |
|---|---|
| Molecular Weight | 211.98 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.98367 |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 19829-31-3 |
|---|---|
| SMILES | CCC(=O)C1=CC(=CC=C1)Br |
| InChIKey | QSHLXVTVXQTHBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanone, 1-(3-bromophenyl)- (CAS 19829-31-3), with molecular formula C9H9BrO and molecular weight 211.98 g/mol. IUPAC: 1-(3-bromophenyl)propan-1-one.
Chemical Property Profile of 1-Propanone, 1-(3-bromophenyl)-
Property Insights of 1-Propanone, 1-(3-bromophenyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 1-(3-bromophenyl)-. With a topological polar surface area (TPSA) of 17.1 Ų, 1-Propanone, 1-(3-bromophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 1-(3-bromophenyl)- has 0 hydrogen bond donor(s) and 1 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 1-Propanone, 1-(3-bromophenyl)-?
The CAS number of 1-Propanone, 1-(3-bromophenyl)- is 19829-31-3.
What is the molecular formula of 1-Propanone, 1-(3-bromophenyl)-?
The molecular formula of 1-Propanone, 1-(3-bromophenyl)- is C9H9BrO.
What is the molecular weight of 1-Propanone, 1-(3-bromophenyl)-?
The molecular weight of 1-Propanone, 1-(3-bromophenyl)- is 211.98 g/mol.
Where can I buy 1-Propanone, 1-(3-bromophenyl)-?
You can request a quote for 1-Propanone, 1-(3-bromophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 1-(3-bromophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 1-(3-bromophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.