Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-
TL;DR: Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- (CAS 73747-30-5) is a chemical compound with molecular formula C17H16BrNO3 and molecular weight 361.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-2-methyl-1-[4-(4-nitrophenyl)phenyl]butan-1-one
Also Known As: 2-Bromo-2-methyl-4'-(p-nitrophenyl)butyrophenone, 2-bromo-2-methyl-1-[4-(4-nitrophenyl)phenyl]butan-1-one, BUTYROPHENONE, 2-BROMO-2-METHYL-4'-(p-NITROPHENYL)-, alpha-Bromo-alpha-methyl-4 -(p-nitrophenyl)butyrophenone, 1-Butanone, 2-bromo-2-methyl-1-(4'-nitro[1,1'-biphenyl]-4-yl)-
| Molecular Formula | C17H16BrNO3 |
|---|---|
| Molecular Weight | 361.03 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.03137 |
| Heavy Atoms | 22 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 73747-30-5 |
|---|---|
| SMILES | CCC(C)(C(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-])Br |
| InChIKey | BTBDSYJRQMVIMH-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- (CAS 73747-30-5), with molecular formula C17H16BrNO3 and molecular weight 361.03 g/mol. IUPAC: 2-bromo-2-methyl-1-[4-(4-nitrophenyl)phenyl]butan-1-one.
Chemical Property Profile of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-
Property Insights of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-
The XLogP value of 5.0 indicates that Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-. Following Lipinski's Rule of Five, Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- 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 Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-?
The CAS number of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- is 73747-30-5.
What is the molecular formula of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-?
The molecular formula of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- is C17H16BrNO3.
What is the molecular weight of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-?
The molecular weight of Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- is 361.03 g/mol.
Where can I buy Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-?
You can request a quote for Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 2-bromo-2-methyl-4'-(p-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.