Dodecyl 4-nitrophenyl sulfone
TL;DR: Dodecyl 4-nitrophenyl sulfone (CAS 94261-92-4) is a chemical compound with molecular formula C18H29NO4S and molecular weight 355.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dodecylsulfonyl-4-nitrobenzene
Also Known As: DODECYL 4-NITROPHENYL SULFONE, 1-dodecylsulfonyl-4-nitrobenzene, 1-(4-nitrophenyl)sulfonyldodecane, 661-267-2, RefChem:590296
| Molecular Formula | C18H29NO4S |
|---|---|
| Molecular Weight | 355.18 g/mol |
| LogP | 5.2894 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 355.18173 |
| Heavy Atoms | 24 |
| Complexity | 581.54126 |
Chemical Identifiers
| CAS Number | 94261-92-4 |
|---|---|
| SMILES | CCCCCCCCCCCCS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
Dodecyl 4-nitrophenyl sulfone (CAS 94261-92-4), with molecular formula C18H29NO4S and molecular weight 355.18 g/mol. IUPAC: 1-dodecylsulfonyl-4-nitrobenzene.
Chemical Property Profile of Dodecyl 4-nitrophenyl sulfone
Property Insights of Dodecyl 4-nitrophenyl sulfone
The XLogP value of 5.2894 indicates that Dodecyl 4-nitrophenyl sulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Dodecyl 4-nitrophenyl sulfone. Following Lipinski's Rule of Five, Dodecyl 4-nitrophenyl sulfone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dodecyl 4-nitrophenyl sulfone?
The CAS number of Dodecyl 4-nitrophenyl sulfone is 94261-92-4.
What is the molecular formula of Dodecyl 4-nitrophenyl sulfone?
The molecular formula of Dodecyl 4-nitrophenyl sulfone is C18H29NO4S.
What is the molecular weight of Dodecyl 4-nitrophenyl sulfone?
The molecular weight of Dodecyl 4-nitrophenyl sulfone is 355.18 g/mol.
Where can I buy Dodecyl 4-nitrophenyl sulfone?
You can request a quote for Dodecyl 4-nitrophenyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecyl 4-nitrophenyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Dodecyl 4-nitrophenyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.