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Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- structure
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Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-

TL;DR: Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- (CAS 147300-16-1) is a chemical compound with molecular formula C14H9BrN2 and molecular weight 283.9949 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[(4-bromophenyl)iminomethyl]benzonitrile

Also Known As: Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-, p-bromo-N-(p-cyanobenzylidene)aniline, 4-(4-Bromophenyliminomethyl)benzonitrile, 4-{[(4-bromophenyl)imino]methyl}benzonitrile, 4-[(4-bromophenyl)iminomethyl]benzonitrile

CAS Number
147300-16-1
Molecular Formula
C14H9BrN2
Molecular Weight
283.9949 g/mol
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Technical Specifications

Molecular FormulaC14H9BrN2
Molecular Weight283.9949 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)36.2 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass283.9949 Da
Heavy Atoms17
Complexity301.0
SMILESC1=CC(=CC=C1C=NC2=CC=C(C=C2)Br)C#N
InChIKeyNTQLGAMAYGGBLZ-UHFFFAOYSA-N

Chemical Property Profile of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-

XLogP
3.6
TPSA (Topological Polar Surface Area)
36.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
17
Complexity
301.0
Exact Mass
283.9949
Monoisotopic Mass
283.9949
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 Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-

The XLogP value of 3.6 indicates that Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.2 Ų, Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-?

The CAS number of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- is 147300-16-1.

What is the molecular formula of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-?

The molecular formula of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- is C14H9BrN2.

What is the molecular weight of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-?

The molecular weight of Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- is 283.9949 g/mol.

Where can I buy Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-?

You can request a quote for Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]-?

Yes, CoreyChem provides custom synthesis services for Benzonitrile, 4-[[(4-bromophenyl)imino]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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