p-Nitrophenyl p-decyloxybenzoate
TL;DR: p-Nitrophenyl p-decyloxybenzoate (CAS 63636-84-0) is a chemical compound with molecular formula C23H29NO5 and molecular weight 399.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 4-decoxybenzoate
Also Known As: p-Nitrophenyl p-decyloxybenzoate, 4-Nitrophenyl 4-(decyloxy)benzoate, (4-nitrophenyl) 4-decoxybenzoate, 4-nitrophenyl 4-decyloxybenzoate, p-nitrophenylp-decyloxybenzoate
| Molecular Formula | C23H29NO5 |
|---|---|
| Molecular Weight | 399.20 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 399.20456 |
| Heavy Atoms | 29 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 63636-84-0 |
|---|---|
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | SYQHCBATGVPGPV-UHFFFAOYSA-N |
Product Overview
p-Nitrophenyl p-decyloxybenzoate (CAS 63636-84-0), with molecular formula C23H29NO5 and molecular weight 399.20 g/mol. IUPAC: (4-nitrophenyl) 4-decoxybenzoate.
Chemical Property Profile of p-Nitrophenyl p-decyloxybenzoate
Property Insights of p-Nitrophenyl p-decyloxybenzoate
The XLogP value of 7.8 indicates that p-Nitrophenyl p-decyloxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Nitrophenyl p-decyloxybenzoate. Following Lipinski's Rule of Five, p-Nitrophenyl p-decyloxybenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of p-Nitrophenyl p-decyloxybenzoate?
The CAS number of p-Nitrophenyl p-decyloxybenzoate is 63636-84-0.
What is the molecular formula of p-Nitrophenyl p-decyloxybenzoate?
The molecular formula of p-Nitrophenyl p-decyloxybenzoate is C23H29NO5.
What is the molecular weight of p-Nitrophenyl p-decyloxybenzoate?
The molecular weight of p-Nitrophenyl p-decyloxybenzoate is 399.20 g/mol.
Where can I buy p-Nitrophenyl p-decyloxybenzoate?
You can request a quote for p-Nitrophenyl p-decyloxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Nitrophenyl p-decyloxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for p-Nitrophenyl p-decyloxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.