Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-
TL;DR: Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- (CAS 67634-04-2) is a chemical compound with molecular formula C28H46O2 and molecular weight 414.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(3,7-dimethyloct-6-enoxy)ethylbenzene
Also Known As: Indium neodecanoate, Indium(3+) neodecanoate, Indium(III) neodecanoate, Neodecanoic acid, indium(3) salt, (2,2-Bis((3,7-dimethyl-6-octenyl)oxy)ethyl)benzene
| Molecular Formula | C28H46O2 |
|---|---|
| Molecular Weight | 414.35 g/mol |
| LogP | 9.4 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 414.3498 |
| Heavy Atoms | 30 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 67634-04-2 |
|---|---|
| SMILES | CC(CCC=C(C)C)CCOC(CC1=CC=CC=C1)OCCC(C)CCC=C(C)C |
| InChIKey | UZCGMNMYZDLKDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- (CAS 67634-04-2), with molecular formula C28H46O2 and molecular weight 414.35 g/mol. IUPAC: 2,2-bis(3,7-dimethyloct-6-enoxy)ethylbenzene.
Chemical Property Profile of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-
Property Insights of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-
The XLogP value of 9.4 indicates that Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-?
The CAS number of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- is 67634-04-2.
What is the molecular formula of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-?
The molecular formula of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- is C28H46O2.
What is the molecular weight of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-?
The molecular weight of Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- is 414.35 g/mol.
Where can I buy Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-?
You can request a quote for Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, [2,2-bis[(3,7-dimethyl-6-octen-1-yl)oxy]ethyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.