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1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine structure
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1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine

TL;DR: 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine (CAS 137918-81-1) is a chemical compound with molecular formula C18H14F6N4O4 and molecular weight 464.09192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,4-bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine

Also Known As: Maybridge1_006503, 1,4-bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine, BAS 00805326, 1,4-di[2-nitro-4-(trifluoromethyl)phenyl]piperazine, 1,4-bis(2-nitro-4-(trifluoromethyl)phenyl)piperazine

CAS Number
137918-81-1
Molecular Formula
C18H14F6N4O4
Molecular Weight
464.09192 g/mol
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Technical Specifications

Molecular FormulaC18H14F6N4O4
Molecular Weight464.09192 g/mol
XLogP5.1
Topological Polar Surface Area (TPSA)98.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors12
Rotatable Bonds2
Exact Mass464.09192 Da
Heavy Atoms32
Complexity629.0
SMILESC1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]
InChIKeyFAYNHZQWDXUAFW-UHFFFAOYSA-N

Chemical Property Profile of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine

XLogP
5.1
TPSA (Topological Polar Surface Area)
98.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
12
Rotatable Bonds
2
Heavy Atoms
32
Complexity
629.0
Exact Mass
464.09192
Monoisotopic Mass
464.09192
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 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine

The XLogP value of 5.1 indicates that 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine. Following Lipinski's Rule of Five, 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine?

The CAS number of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine is 137918-81-1.

What is the molecular formula of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine?

The molecular formula of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine is C18H14F6N4O4.

What is the molecular weight of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine?

The molecular weight of 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine is 464.09192 g/mol.

Where can I buy 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine?

You can request a quote for 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine?

Yes, CoreyChem provides custom synthesis services for 1,4-Bis[2-nitro-4-(trifluoromethyl)phenyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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