1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one
TL;DR: 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one (CAS 27911-82-6) is a chemical compound with molecular formula C17H13NO3 and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-nitrophenyl)-5-phenylpenta-1,4-dien-3-one
Also Known As: 1-(3-nitrophenyl)-5-phenylpenta-1,4-dien-3-one, 1-(3-nitrophenyl)-5-phenyl-penta-1,4-dien-3-one, 1-(3-NITROPHENYL)-5-PHENYL-1,4-PENTADIEN-3-ONE
| Molecular Formula | C17H13NO3 |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 3.8905 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.08954 |
| Heavy Atoms | 21 |
| Complexity | 702.985 |
Chemical Identifiers
| CAS Number | 27911-82-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one (CAS 27911-82-6), with molecular formula C17H13NO3 and molecular weight 279.09 g/mol. IUPAC: 1-(3-nitrophenyl)-5-phenylpenta-1,4-dien-3-one.
Chemical Property Profile of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one
Property Insights of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one
The XLogP value of 3.8905 indicates that 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one. Following Lipinski's Rule of Five, 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one has 0 hydrogen bond donor(s) and 3 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 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one?
The CAS number of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one is 27911-82-6.
What is the molecular formula of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one?
The molecular formula of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one is C17H13NO3.
What is the molecular weight of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one?
The molecular weight of 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one is 279.09 g/mol.
Where can I buy 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one?
You can request a quote for 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Nitrophenyl)-5-phenylpenta-1,4-dien-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.