[4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate
TL;DR: [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate (CAS 107133-34-6) is a chemical compound with molecular formula C29H40O5 and molecular weight 468.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3-propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate
Also Known As: 4-[(S,S)-2,3-Epoxyhexyloxy]phenyl 4-(decyloxy)benzoate, J1.178.498D, [4-[(3-propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate, [4-[[(2S,3S)-3-propyloxiran-2-yl]methoxy]phenyl] 4-decoxybenzoate, 4-(Decyloxy)benzoic acid 4-[(3-propyloxiranyl)methoxy]phenyl ester
| Molecular Formula | C29H40O5 |
|---|---|
| Molecular Weight | 468.29 g/mol |
| LogP | 7.3716 |
| Topological Polar Surface Area | 57.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 17 |
| Exact Mass | 468.28757 |
| Heavy Atoms | 34 |
| Complexity | 830.6044 |
Chemical Identifiers
| CAS Number | 107133-34-6 |
|---|---|
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC3C(O3)CCC |
Product Overview
[4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate (CAS 107133-34-6), with molecular formula C29H40O5 and molecular weight 468.29 g/mol. IUPAC: [4-[(3-propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate.
Chemical Property Profile of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate
Property Insights of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate
The XLogP value of 7.3716 indicates that [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.29 Ų, [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate?
The CAS number of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate is 107133-34-6.
What is the molecular formula of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate?
The molecular formula of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate is C29H40O5.
What is the molecular weight of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate?
The molecular weight of [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate is 468.29 g/mol.
Where can I buy [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate?
You can request a quote for [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-[(3-Propyloxiran-2-yl)methoxy]phenyl] 4-decoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.