4-甲基辛二酸
TL;DR: 4-甲基辛二酸 (CAS 90647-67-9) is a chemical compound with molecular formula C9H16O4 and molecular weight 188.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲基辛二酸
4-methyloctanedioic acid
Also Known As: 4-Methylsuberic acid, 4-methyloctanedioic acid, 4-methyl-octanedioic acid, RefChem:99945
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10 g/mol |
| LogP | 1.7422 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 176.45352 |
Chemical Identifiers
| CAS Number | 90647-67-9 |
|---|---|
| SMILES | CC(CCCC(=O)O)CCC(=O)O |
Product Overview
4-甲基辛二酸 (CAS 90647-67-9), with molecular formula C9H16O4 and molecular weight 188.10 g/mol. IUPAC: 4-methyloctanedioic acid.
Chemical Property Profile of 4-甲基辛二酸
Property Insights of 4-甲基辛二酸
The XLogP value of 1.7422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲基辛二酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-甲基辛二酸. Following Lipinski's Rule of Five, 4-甲基辛二酸 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 4-甲基辛二酸?
The CAS number of 4-甲基辛二酸 is 90647-67-9.
What is the molecular formula of 4-甲基辛二酸?
The molecular formula of 4-甲基辛二酸 is C9H16O4.
What is the molecular weight of 4-甲基辛二酸?
The molecular weight of 4-甲基辛二酸 is 188.10 g/mol.
Where can I buy 4-甲基辛二酸?
You can request a quote for 4-甲基辛二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲基辛二酸?
Yes, KEHONG BIO provides custom synthesis services for 4-甲基辛二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.