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[(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) structure
Fine Chemical

[(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)

TL;DR: [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) (CAS 153562-59-5) is a chemical compound with molecular formula C24H26FNO6S2 and molecular weight 507.11856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[3-fluoro-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]ethyl 4-methylbenzenesulfonate

Also Known As: KST-1A1662, [(3-fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate), 2-[3-fluoro-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]et, 2-[3-fluoro-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]ethyl 4-methylbenzenesulfonate, [(3-nitrophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)

CAS Number
153562-59-5
Molecular Formula
C24H26FNO6S2
Molecular Weight
507.11856 g/mol
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Technical Specifications

Molecular FormulaC24H26FNO6S2
Molecular Weight507.11856 g/mol
XLogP4.8
Topological Polar Surface Area (TPSA)107.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds11
Exact Mass507.11856 Da
Heavy Atoms34
Complexity751.0
SMILESCC1=CC=C(C=C1)S(=O)(=O)OCCN(CCOS(=O)(=O)C2=CC=C(C=C2)C)C3=CC(=CC=C3)F
InChIKeyZTJNWVDVSDVMFL-UHFFFAOYSA-N

Chemical Property Profile of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)

XLogP
4.8
TPSA (Topological Polar Surface Area)
107.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
11
Heavy Atoms
34
Complexity
751.0
Exact Mass
507.11856
Monoisotopic Mass
507.11856
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)

The XLogP value of 4.8 indicates that [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate). Following Lipinski's Rule of Five, [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)?

The CAS number of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) is 153562-59-5.

What is the molecular formula of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)?

The molecular formula of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) is C24H26FNO6S2.

What is the molecular weight of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)?

The molecular weight of [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) is 507.11856 g/mol.

Where can I buy [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)?

You can request a quote for [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate)?

Yes, CoreyChem provides custom synthesis services for [(3-Fluorophenyl)imino]diethane-2,1-diyl bis(4-methylbenzenesulfonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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