3'-Methylpropiophenone
TL;DR: 3'-Methylpropiophenone (CAS 51772-30-6) is a chemical compound with molecular formula C10H12O and molecular weight 148.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylphenyl)propan-1-one
Also Known As: 3'-Methylpropiophenone, m-METHYLPROPIOPHENONE, 1-(m-Tolyl)propan-1-one, 1-(3-methylphenyl)propan-1-one, m-n-propoyltoluene
| Molecular Formula | C10H12O |
|---|---|
| Molecular Weight | 148.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 148.08882 |
| Heavy Atoms | 11 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 51772-30-6 |
|---|---|
| SMILES | CCC(=O)C1=CC=CC(=C1)C |
| InChIKey | QHVNQIJBHWOZRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3'-Methylpropiophenone (CAS 51772-30-6), with molecular formula C10H12O and molecular weight 148.09 g/mol. IUPAC: 1-(3-methylphenyl)propan-1-one.
Chemical Property Profile of 3'-Methylpropiophenone
Property Insights of 3'-Methylpropiophenone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-Methylpropiophenone. With a topological polar surface area (TPSA) of 17.1 Ų, 3'-Methylpropiophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-Methylpropiophenone 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 3'-Methylpropiophenone?
The CAS number of 3'-Methylpropiophenone is 51772-30-6.
What is the molecular formula of 3'-Methylpropiophenone?
The molecular formula of 3'-Methylpropiophenone is C10H12O.
What is the molecular weight of 3'-Methylpropiophenone?
The molecular weight of 3'-Methylpropiophenone is 148.09 g/mol.
Where can I buy 3'-Methylpropiophenone?
You can request a quote for 3'-Methylpropiophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Methylpropiophenone?
Yes, KEHONG BIO provides custom synthesis services for 3'-Methylpropiophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.