Benzene, 1-tert-butyl-4-dodecyl-oxy-
TL;DR: Benzene, 1-tert-butyl-4-dodecyl-oxy- (CAS 6940-96-1) is a chemical compound with molecular formula C22H38O and molecular weight 318.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-4-dodecoxybenzene
Also Known As: Benzene, 1-tert-butyl-4-dodecyl-oxy-, 4-TERT-BUTYLPHENYL DODECYL ETHER, 1-tert-butyl-4-dodecoxybenzene, Benzene, 1-tert-butyl-4-dodecyl-oxy-,, 1-TERT-BUTYL-4-(DODECYLOXY)BENZENE
| Molecular Formula | C22H38O |
|---|---|
| Molecular Weight | 318.29 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 13 |
| Exact Mass | 318.29227 |
| Heavy Atoms | 23 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 6940-96-1 |
|---|---|
| SMILES | CCCCCCCCCCCCOC1=CC=C(C=C1)C(C)(C)C |
| InChIKey | AUYPJCDTURCDRS-UHFFFAOYSA-N |
Product Overview
Benzene, 1-tert-butyl-4-dodecyl-oxy- (CAS 6940-96-1), with molecular formula C22H38O and molecular weight 318.29 g/mol. IUPAC: 1-tert-butyl-4-dodecoxybenzene.
Chemical Property Profile of Benzene, 1-tert-butyl-4-dodecyl-oxy-
Property Insights of Benzene, 1-tert-butyl-4-dodecyl-oxy-
The XLogP value of 9.3 indicates that Benzene, 1-tert-butyl-4-dodecyl-oxy- 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-tert-butyl-4-dodecyl-oxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-tert-butyl-4-dodecyl-oxy- 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-tert-butyl-4-dodecyl-oxy-?
The CAS number of Benzene, 1-tert-butyl-4-dodecyl-oxy- is 6940-96-1.
What is the molecular formula of Benzene, 1-tert-butyl-4-dodecyl-oxy-?
The molecular formula of Benzene, 1-tert-butyl-4-dodecyl-oxy- is C22H38O.
What is the molecular weight of Benzene, 1-tert-butyl-4-dodecyl-oxy-?
The molecular weight of Benzene, 1-tert-butyl-4-dodecyl-oxy- is 318.29 g/mol.
Where can I buy Benzene, 1-tert-butyl-4-dodecyl-oxy-?
You can request a quote for Benzene, 1-tert-butyl-4-dodecyl-oxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-tert-butyl-4-dodecyl-oxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-tert-butyl-4-dodecyl-oxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.