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N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine structure
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N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine

TL;DR: N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine (CAS 1039005-31-6) is a chemical compound with molecular formula C11H11ClN4O2 and molecular weight 266.05707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine

Also Known As: N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine, [2-(4-chlorophenyl)ethyl](4-nitropyrazol-5-yl)amine, N-[2-(4-chlorophenyl)ethyl]-4-nitro-2H-pyrazol-3-amine, N-(4-CHLOROPHENETHYL)-N-(4-NITRO-1H-PYRAZOL-5-YL)AMINE

CAS Number
1039005-31-6
Molecular Formula
C11H11ClN4O2
Molecular Weight
266.05707 g/mol
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Technical Specifications

Molecular FormulaC11H11ClN4O2
Molecular Weight266.05707 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)86.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass266.05707 Da
Heavy Atoms18
Complexity279.0
SMILESC1=CC(=CC=C1CCNC2=C(C=NN2)[N+](=O)[O-])Cl
InChIKeyOKXRLVHXMOITBE-UHFFFAOYSA-N

Chemical Property Profile of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine

XLogP
3.5
TPSA (Topological Polar Surface Area)
86.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
18
Complexity
279.0
Exact Mass
266.05707
Monoisotopic Mass
266.05707
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 N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine

The XLogP value of 3.5 indicates that N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine. Following Lipinski's Rule of Five, N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine?

The CAS number of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine is 1039005-31-6.

What is the molecular formula of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine?

The molecular formula of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine is C11H11ClN4O2.

What is the molecular weight of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine?

The molecular weight of N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine is 266.05707 g/mol.

Where can I buy N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine?

You can request a quote for N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine?

Yes, CoreyChem provides custom synthesis services for N-[2-(4-chlorophenyl)ethyl]-4-nitro-1H-pyrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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