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Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester structure
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Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester

TL;DR: Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester (CAS 141380-75-8) is a chemical compound with molecular formula C15H17N2O5P and molecular weight 336.0875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[dimethoxyphosphoryl-(4-nitrophenyl)methyl]aniline

Also Known As: N-[dimethoxyphosphoryl-(4-nitrophenyl)methyl]aniline, dimethyl [(4-nitrophenyl)(phenylamino)methyl]phosphonate, Dimethyl [anilino(4-nitrophenyl)methyl]phosphonate, Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester, alpha-Anilino-4-nitrobenzylphosphonic acid dimethyl ester

CAS Number
141380-75-8
Molecular Formula
C15H17N2O5P
Molecular Weight
336.0875 g/mol
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Technical Specifications

Molecular FormulaC15H17N2O5P
Molecular Weight336.0875 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)93.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass336.0875 Da
Heavy Atoms23
Complexity420.0
SMILESCOP(=O)(C(C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=CC=C2)OC
InChIKeyDRMKQTHRBPDLFD-UHFFFAOYSA-N

Chemical Property Profile of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester

XLogP
2.6
TPSA (Topological Polar Surface Area)
93.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
23
Complexity
420.0
Exact Mass
336.0875
Monoisotopic Mass
336.0875
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 Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester. Following Lipinski's Rule of Five, Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester?

The CAS number of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester is 141380-75-8.

What is the molecular formula of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester?

The molecular formula of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester is C15H17N2O5P.

What is the molecular weight of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester?

The molecular weight of Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester is 336.0875 g/mol.

Where can I buy Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester?

You can request a quote for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester?

Yes, CoreyChem provides custom synthesis services for Phosphonic acid, [(4-nitrophenyl)(phenylamino)methyl]-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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