RefChem:1082681
TL;DR: RefChem:1082681 (CAS 129344-92-9) is a chemical compound with molecular formula C19H33NO6 and molecular weight 371.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;2-(dimethylamino)ethyl 2-cyclopentylhexanoate
Also Known As: 2-dimethylaminoethyl 2-cyclopentylhexanoate, 2-(Dimethylamino)ethyl alpha-butylcyclopentaneacetate (E)-2-butenedioate (1:1), Cyclopentaneacetic acid, alpha-butyl-, 2-(dimethylamino)ethyl ester, (E)-2-butenedioate (1:1), (E)-but-2-enedioic acid;2-(dimethylamino)ethyl 2-cyclopentylhexanoate, (E)-but-2-enedioic acid,2-(dimethylamino)ethyl 2-cyclopentyl
| Molecular Formula | C19H33NO6 |
|---|---|
| Molecular Weight | 371.23 g/mol |
| LogP | 2.7996 |
| Topological Polar Surface Area | 104.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 371.23077 |
| Heavy Atoms | 26 |
| Complexity | 438.9457 |
Chemical Identifiers
| CAS Number | 129344-92-9 |
|---|---|
| SMILES | CCCCC(C1CCCC1)C(=O)OCCN(C)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1082681 (CAS 129344-92-9), with molecular formula C19H33NO6 and molecular weight 371.23 g/mol. IUPAC: (E)-but-2-enedioic acid;2-(dimethylamino)ethyl 2-cyclopentylhexanoate.
Chemical Property Profile of RefChem:1082681
Property Insights of RefChem:1082681
The XLogP value of 2.7996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1082681. The TPSA of 104.14 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1082681. Following Lipinski's Rule of Five, RefChem:1082681 has 2 hydrogen bond donor(s) and 5 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 RefChem:1082681?
The CAS number of RefChem:1082681 is 129344-92-9.
What is the molecular formula of RefChem:1082681?
The molecular formula of RefChem:1082681 is C19H33NO6.
What is the molecular weight of RefChem:1082681?
The molecular weight of RefChem:1082681 is 371.23 g/mol.
Where can I buy RefChem:1082681?
You can request a quote for RefChem:1082681 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1082681?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1082681 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.