3,7-二甲基-7-苯基辛酸
TL;DR: 3,7-二甲基-7-苯基辛酸 (CAS 93156-68-4) is a chemical compound with molecular formula C16H24O2 and molecular weight 248.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-二甲基-7-苯基辛酸
3,7-dimethyl-7-phenyloctanoic acid
Also Known As: 3,7-Dimethyl-7-phenyloctanoic acid, OCTANOIC ACID, 3,7-DIMETHYL-7-PHENYL-, 4-09-00-01974 (Beilstein Handbook Reference), RefChem:1066152, BRN 3309359
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.18 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 93156-68-4 |
|---|---|
| SMILES | CC(CCCC(C)(C)C1=CC=CC=C1)CC(=O)O |
| InChIKey | UFKZMQRFWRINLL-UHFFFAOYSA-N |
Product Overview
3,7-二甲基-7-苯基辛酸 (CAS 93156-68-4), with molecular formula C16H24O2 and molecular weight 248.18 g/mol. IUPAC: 3,7-dimethyl-7-phenyloctanoic acid.
Chemical Property Profile of 3,7-二甲基-7-苯基辛酸
Property Insights of 3,7-二甲基-7-苯基辛酸
The XLogP value of 5.0 indicates that 3,7-二甲基-7-苯基辛酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3,7-二甲基-7-苯基辛酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-二甲基-7-苯基辛酸 has 1 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 3,7-二甲基-7-苯基辛酸?
The CAS number of 3,7-二甲基-7-苯基辛酸 is 93156-68-4.
What is the molecular formula of 3,7-二甲基-7-苯基辛酸?
The molecular formula of 3,7-二甲基-7-苯基辛酸 is C16H24O2.
What is the molecular weight of 3,7-二甲基-7-苯基辛酸?
The molecular weight of 3,7-二甲基-7-苯基辛酸 is 248.18 g/mol.
Where can I buy 3,7-二甲基-7-苯基辛酸?
You can request a quote for 3,7-二甲基-7-苯基辛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-二甲基-7-苯基辛酸?
Yes, KEHONG BIO provides custom synthesis services for 3,7-二甲基-7-苯基辛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.