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3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid structure
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3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid

TL;DR: 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid (CAS 134701-70-5) is a chemical compound with molecular formula C30H32N2O2 and molecular weight 452.24637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid

Also Known As: 3,4,5-Tpna, 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid, BMY 42239, 9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid, 3,4,5-triphenyl-1H-pyrazole-1-nonanoicacid

CAS Number
134701-70-5
Molecular Formula
C30H32N2O2
Molecular Weight
452.24637 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (9 patents) Pharmaceutical Intermediates (4 patents)

Technical Specifications

Molecular FormulaC30H32N2O2
Molecular Weight452.24637 g/mol
XLogP7.3
Topological Polar Surface Area (TPSA)55.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds12
Exact Mass452.24637 Da
Heavy Atoms34
Complexity578.0
SMILESC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCC(=O)O)C4=CC=CC=C4
InChIKeyUQKNBUMTTCHIOJ-UHFFFAOYSA-N

Chemical Property Profile of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid

XLogP
7.3
TPSA (Topological Polar Surface Area)
55.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
12
Heavy Atoms
34
Complexity
578.0
Exact Mass
452.24637
Monoisotopic Mass
452.24637
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 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid

The XLogP value of 7.3 indicates that 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid?

The CAS number of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid is 134701-70-5.

What is the molecular formula of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid?

The molecular formula of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid is C30H32N2O2.

What is the molecular weight of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid?

The molecular weight of 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid is 452.24637 g/mol.

Where can I buy 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid?

You can request a quote for 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid?

Yes, CoreyChem provides custom synthesis services for 3,4,5-Triphenyl-1H-pyrazole-1-nonanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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