Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-
TL;DR: Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- (CAS 143239-02-5) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-2-methyl-3-(3-phenylmethoxyphenyl)propyl] acetate
Also Known As: J1.372.229C, (2S)-3-[3-(benzyloxy)phenyl]-2-methylpropyl acetate, Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-, [2-methyl-3-(3-phenylmethoxyphenyl)propyl] Acetate, 3-[3-(BENZYLOXY)PHENYL]-2-METHYLPROPYL ACETATE
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 143239-02-5 |
|---|---|
| SMILES | C[C@@H](CC1=CC(=CC=C1)OCC2=CC=CC=C2)COC(=O)C |
| InChIKey | XHLMQTCPXXCIRL-HNNXBMFYSA-N |
Product Overview
Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- (CAS 143239-02-5), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: [(2S)-2-methyl-3-(3-phenylmethoxyphenyl)propyl] acetate.
Chemical Property Profile of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-
Property Insights of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-
The XLogP value of 4.3 indicates that Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- has 0 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 Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-?
The CAS number of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- is 143239-02-5.
What is the molecular formula of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-?
The molecular formula of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- is C19H22O3.
What is the molecular weight of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-?
The molecular weight of Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- is 298.16 g/mol.
Where can I buy Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-?
You can request a quote for Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanol, beta-methyl-3-(phenylmethoxy)-, acetate, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.