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o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- structure
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o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-

TL;DR: o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- (CAS 96004-78-3) is a chemical compound with molecular formula C26H37NO7 and molecular weight 475.257 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[1-(3,4-dihydroxyphenyl)propan-2-yl-propylamino]butyl 3,4,5-trimethoxybenzoate

Also Known As: 1,2-Benzenediol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-, o-CATECHOL, 4-(2-(N-PROPYL-N-(4-(3,4,5-TRIMETHOXYBENZOYLOXY)BUTYL)AMINO)PROPYL)-, 4-(2-(N-Propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-o-catechol, 4-{[1-(3,4-Dihydroxyphenyl)propan-2-yl](propyl)amino}butyl 3,4,5-trimethoxybenzoate, 4-[1-(3,4-dihydroxyphenyl)propan-2-yl-propylamino]butyl 3,4,5-trimethoxybenzoate

CAS Number
96004-78-3
Molecular Formula
C26H37NO7
Molecular Weight
475.257 g/mol
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Technical Specifications

Molecular FormulaC26H37NO7
Molecular Weight475.257 g/mol
XLogP5.0
Topological Polar Surface Area (TPSA)97.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds15
Exact Mass475.257 Da
Heavy Atoms34
Complexity563.0
SMILESCCCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)C(C)CC2=CC(=C(C=C2)O)O
InChIKeyMTEKJUQZXSIOQR-UHFFFAOYSA-N

Chemical Property Profile of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-

XLogP
5.0
TPSA (Topological Polar Surface Area)
97.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
15
Heavy Atoms
34
Complexity
563.0
Exact Mass
475.257
Monoisotopic Mass
475.257
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 o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-

The XLogP value of 5.0 indicates that o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.7 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-. Following Lipinski's Rule of Five, o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-?

The CAS number of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- is 96004-78-3.

What is the molecular formula of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-?

The molecular formula of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- is C26H37NO7.

What is the molecular weight of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-?

The molecular weight of o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- is 475.257 g/mol.

Where can I buy o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-?

You can request a quote for o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)-?

Yes, CoreyChem provides custom synthesis services for o-Catechol, 4-(2-(N-propyl-N-(4-(3,4,5-trimethoxybenzoyloxy)butyl)amino)propyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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