(4-Methylphenyl)phenylmethyl 4-nitrobenzoate
TL;DR: (4-Methylphenyl)phenylmethyl 4-nitrobenzoate (CAS 32435-32-8) is a chemical compound with molecular formula C21H17NO4 and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-methylphenyl)-phenylmethyl] 4-nitrobenzoate
Also Known As: 4-methylbenzhydryl 4-nitrobenzoate, (4-methylphenyl)phenylmethyl 4-nitrobenzoate, [(4-methylphenyl)-phenylmethyl] 4-nitrobenzoate, (4-methylphenyl)(phenyl)methyl 4-nitrobenzoate, (4-methylphenyl)(phenyl)methyl4-nitrobenzoate
| Molecular Formula | C21H17NO4 |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 4.84962 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.11575 |
| Heavy Atoms | 26 |
| Complexity | 903.0058 |
Chemical Identifiers
| CAS Number | 32435-32-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
(4-Methylphenyl)phenylmethyl 4-nitrobenzoate (CAS 32435-32-8), with molecular formula C21H17NO4 and molecular weight 347.12 g/mol. IUPAC: [(4-methylphenyl)-phenylmethyl] 4-nitrobenzoate.
Chemical Property Profile of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate
Property Insights of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate
The XLogP value of 4.84962 indicates that (4-Methylphenyl)phenylmethyl 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Methylphenyl)phenylmethyl 4-nitrobenzoate. Following Lipinski's Rule of Five, (4-Methylphenyl)phenylmethyl 4-nitrobenzoate 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 (4-Methylphenyl)phenylmethyl 4-nitrobenzoate?
The CAS number of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate is 32435-32-8.
What is the molecular formula of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate?
The molecular formula of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate is C21H17NO4.
What is the molecular weight of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate?
The molecular weight of (4-Methylphenyl)phenylmethyl 4-nitrobenzoate is 347.12 g/mol.
Where can I buy (4-Methylphenyl)phenylmethyl 4-nitrobenzoate?
You can request a quote for (4-Methylphenyl)phenylmethyl 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methylphenyl)phenylmethyl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Methylphenyl)phenylmethyl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.