Benzene, 1-(1-methylpentadecyl)-4-phenoxy-
TL;DR: Benzene, 1-(1-methylpentadecyl)-4-phenoxy- (CAS 68141-03-7) is a chemical compound with molecular formula C28H42O and molecular weight 394.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexadecan-2-yl-4-phenoxybenzene
Also Known As: Phenoxyphenylcetane, 1-(hexadecan-2-yl)-4-phenoxybenzene, 1-(1-Methylpentadecyl)-4-phenoxybenzene, 2-(4-phenoxyphenyl)hexadecane, 1- -4-PHENOXYBENZENE
| Molecular Formula | C28H42O |
|---|---|
| Molecular Weight | 394.32 g/mol |
| LogP | 11.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 16 |
| Exact Mass | 394.32358 |
| Heavy Atoms | 29 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 68141-03-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)OC2=CC=CC=C2 |
| InChIKey | ZKDMPXKVJFLUSA-UHFFFAOYSA-N |
Product Overview
Benzene, 1-(1-methylpentadecyl)-4-phenoxy- (CAS 68141-03-7), with molecular formula C28H42O and molecular weight 394.32 g/mol. IUPAC: 1-hexadecan-2-yl-4-phenoxybenzene.
Chemical Property Profile of Benzene, 1-(1-methylpentadecyl)-4-phenoxy-
Property Insights of Benzene, 1-(1-methylpentadecyl)-4-phenoxy-
The XLogP value of 11.6 indicates that Benzene, 1-(1-methylpentadecyl)-4-phenoxy- 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-(1-methylpentadecyl)-4-phenoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-(1-methylpentadecyl)-4-phenoxy- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1-(1-methylpentadecyl)-4-phenoxy-?
The CAS number of Benzene, 1-(1-methylpentadecyl)-4-phenoxy- is 68141-03-7.
What is the molecular formula of Benzene, 1-(1-methylpentadecyl)-4-phenoxy-?
The molecular formula of Benzene, 1-(1-methylpentadecyl)-4-phenoxy- is C28H42O.
What is the molecular weight of Benzene, 1-(1-methylpentadecyl)-4-phenoxy-?
The molecular weight of Benzene, 1-(1-methylpentadecyl)-4-phenoxy- is 394.32 g/mol.
Where can I buy Benzene, 1-(1-methylpentadecyl)-4-phenoxy-?
You can request a quote for Benzene, 1-(1-methylpentadecyl)-4-phenoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-(1-methylpentadecyl)-4-phenoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-(1-methylpentadecyl)-4-phenoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.