尼艾酚
TL;DR: 尼艾酚 (CAS 96895-25-9) is a chemical compound with molecular formula C17H16O2 and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尼艾酚
4-[(3R)-3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol
Also Known As: 4,4'-(3-Ethenyl-1-propene-1,3-diyl)-bisphenol, 4-[(3R)-3-(4-Hydroxyphenyl)penta-1,4-dienyl]phenol, Phenol, 4,4'-[(1Z,3R)-3-ethenyl-1-propene-1,3-diyl]bis-
| Molecular Formula | C17H16O2 |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11504 |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 96895-25-9 |
|---|---|
| SMILES | C=C[C@H](C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
| InChIKey | VEAUNWQYYMXIRB-CQSZACIVSA-N |
Product Overview
尼艾酚 (CAS 96895-25-9), with molecular formula C17H16O2 and molecular weight 252.12 g/mol. IUPAC: 4-[(3R)-3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol.
Chemical Property Profile of 尼艾酚
Property Insights of 尼艾酚
The XLogP value of 4.4 indicates that 尼艾酚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 尼艾酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 尼艾酚 has 2 hydrogen bond donor(s) and 2 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 尼艾酚?
The CAS number of 尼艾酚 is 96895-25-9.
What is the molecular formula of 尼艾酚?
The molecular formula of 尼艾酚 is C17H16O2.
What is the molecular weight of 尼艾酚?
The molecular weight of 尼艾酚 is 252.12 g/mol.
Where can I buy 尼艾酚?
You can request a quote for 尼艾酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尼艾酚?
Yes, KEHONG BIO provides custom synthesis services for 尼艾酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.