![benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- structure](/static/products/2351/23517-07-9.webp)
benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-
TL;DR: benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- (CAS 23517-07-9) is a chemical compound with molecular formula C11H10O and molecular weight 158.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-but-1-en-3-ynyl]-4-methoxybenzene
Also Known As: 1-(4-Methoxyphenyl)-1-butene-3-yne, (E)-1-(but-1-en-3-ynyl)-4-methoxybenzene, (E)-1-(4-Methoxyphenyl)-1-butene-3-yne, (E)-4-(4-Methoxyphenyl)-3-buten-1-yne, 1-(but-1-en-3-yn-1-yl)-4-methoxybenzene
| Molecular Formula | C11H10O |
|---|---|
| Molecular Weight | 158.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.07317 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 23517-07-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/C#C |
| InChIKey | QVXLKHZWUPLMFN-SNAWJCMRSA-N |
Product Overview
benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- (CAS 23517-07-9), with molecular formula C11H10O and molecular weight 158.07 g/mol. IUPAC: 1-[(E)-but-1-en-3-ynyl]-4-methoxybenzene.
Chemical Property Profile of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-
Property Insights of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-
The XLogP value of 3.2 indicates that benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- 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 benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-?
The CAS number of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- is 23517-07-9.
What is the molecular formula of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-?
The molecular formula of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- is C11H10O.
What is the molecular weight of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-?
The molecular weight of benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- is 158.07 g/mol.
Where can I buy benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-?
You can request a quote for benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for benzene, 1-[(1E)-1-buten-3-ynyl]-4-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.