RefChem:122019
TL;DR: RefChem:122019 (CAS 69929-08-4) is a chemical compound with molecular formula C14H24O4 and molecular weight 256.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(Z)-2,4,4-trimethylpent-1-enyl]butanedioate
Also Known As: EINECS 274-219-7, Dimethyl (2,4,4-trimethylpentyl)succinate, didehydro derivative, Butanedioic acid, (2,4,4-trimethylpentyl)-, dimethyl ester, didehydro deriv., Butanedioic acid, 2-(2,4,4-trimethylpentyl)-, 1,4-dimethyl ester, didehydro deriv., dimethyl 2-[(Z)-2,4,4-trimethylpent-1-enyl]butanedioate
| Molecular Formula | C14H24O4 |
|---|---|
| Molecular Weight | 256.17 g/mol |
| LogP | 2.7212 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.16745 |
| Heavy Atoms | 18 |
| Complexity | 323.1759 |
Chemical Identifiers
| CAS Number | 69929-08-4 |
|---|---|
| SMILES | C/C(=C/C(CC(=O)OC)C(=O)OC)/CC(C)(C)C |
Product Overview
RefChem:122019 (CAS 69929-08-4), with molecular formula C14H24O4 and molecular weight 256.17 g/mol. IUPAC: dimethyl 2-[(Z)-2,4,4-trimethylpent-1-enyl]butanedioate.
Chemical Property Profile of RefChem:122019
Property Insights of RefChem:122019
The XLogP value of 2.7212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:122019. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:122019 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:122019 has 0 hydrogen bond donor(s) and 4 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:122019?
The CAS number of RefChem:122019 is 69929-08-4.
What is the molecular formula of RefChem:122019?
The molecular formula of RefChem:122019 is C14H24O4.
What is the molecular weight of RefChem:122019?
The molecular weight of RefChem:122019 is 256.17 g/mol.
Where can I buy RefChem:122019?
You can request a quote for RefChem:122019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:122019?
Yes, KEHONG BIO provides custom synthesis services for RefChem:122019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.