Bis(2-methylpropyl) 4-(dimethylamino)phthalate
TL;DR: Bis(2-methylpropyl) 4-(dimethylamino)phthalate (CAS 84787-86-0) is a chemical compound with molecular formula C18H27NO4 and molecular weight 321.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methylpropyl) 4-(dimethylamino)benzene-1,2-dicarboxylate
Also Known As: EINECS 284-127-9, Bis(2-methylpropyl) 4-(dimethylamino)phthalate, bis(2-methylpropyl) 4-(dimethylamino)benzene-1,2-dicarboxylate, BIS-(2-METHYLPROPYL) 4-(DIMETHYLAMINO)PHTHALATE, 1,2-bis(2-methylpropyl) 4-(dimethylamino)benzene-1,2-dicarboxylate
| Molecular Formula | C18H27NO4 |
|---|---|
| Molecular Weight | 321.19 g/mol |
| LogP | 3.3782 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 321.194 |
| Heavy Atoms | 23 |
| Complexity | 549.95264 |
Chemical Identifiers
| CAS Number | 84787-86-0 |
|---|---|
| SMILES | CC(C)COC(=O)C1=C(C=C(C=C1)N(C)C)C(=O)OCC(C)C |
Product Overview
Bis(2-methylpropyl) 4-(dimethylamino)phthalate (CAS 84787-86-0), with molecular formula C18H27NO4 and molecular weight 321.19 g/mol. IUPAC: bis(2-methylpropyl) 4-(dimethylamino)benzene-1,2-dicarboxylate.
Chemical Property Profile of Bis(2-methylpropyl) 4-(dimethylamino)phthalate
Property Insights of Bis(2-methylpropyl) 4-(dimethylamino)phthalate
The XLogP value of 3.3782 indicates that Bis(2-methylpropyl) 4-(dimethylamino)phthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, Bis(2-methylpropyl) 4-(dimethylamino)phthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-methylpropyl) 4-(dimethylamino)phthalate has 0 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 Bis(2-methylpropyl) 4-(dimethylamino)phthalate?
The CAS number of Bis(2-methylpropyl) 4-(dimethylamino)phthalate is 84787-86-0.
What is the molecular formula of Bis(2-methylpropyl) 4-(dimethylamino)phthalate?
The molecular formula of Bis(2-methylpropyl) 4-(dimethylamino)phthalate is C18H27NO4.
What is the molecular weight of Bis(2-methylpropyl) 4-(dimethylamino)phthalate?
The molecular weight of Bis(2-methylpropyl) 4-(dimethylamino)phthalate is 321.19 g/mol.
Where can I buy Bis(2-methylpropyl) 4-(dimethylamino)phthalate?
You can request a quote for Bis(2-methylpropyl) 4-(dimethylamino)phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-methylpropyl) 4-(dimethylamino)phthalate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-methylpropyl) 4-(dimethylamino)phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.