Phenyl isocyanide, p-benzoyl-
TL;DR: Phenyl isocyanide, p-benzoyl- (CAS 3128-83-4) is a chemical compound with molecular formula C14H9NO and molecular weight 207.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-isocyanophenyl)-phenylmethanone
Also Known As: 4-Isocyanobenzophenone, cimaterol, (4-isocyanophenyl)(phenyl)methanone, p-Benzoylphenyl isocyanide, Methanone,(4-isocyanophenyl)phenyl-
| Molecular Formula | C14H9NO |
|---|---|
| Molecular Weight | 207.07 g/mol |
| LogP | 3.46839 |
| Topological Polar Surface Area | 21.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.06842 |
| Heavy Atoms | 16 |
| Complexity | 535.19806 |
Chemical Identifiers
| CAS Number | 3128-83-4 |
|---|---|
| SMILES | [C-]#[N+]C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
Product Overview
Phenyl isocyanide, p-benzoyl- (CAS 3128-83-4), with molecular formula C14H9NO and molecular weight 207.07 g/mol. IUPAC: (4-isocyanophenyl)-phenylmethanone.
Chemical Property Profile of Phenyl isocyanide, p-benzoyl-
Property Insights of Phenyl isocyanide, p-benzoyl-
The XLogP value of 3.46839 indicates that Phenyl isocyanide, p-benzoyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.43 Ų, Phenyl isocyanide, p-benzoyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl isocyanide, p-benzoyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenyl isocyanide, p-benzoyl-?
The CAS number of Phenyl isocyanide, p-benzoyl- is 3128-83-4.
What is the molecular formula of Phenyl isocyanide, p-benzoyl-?
The molecular formula of Phenyl isocyanide, p-benzoyl- is C14H9NO.
What is the molecular weight of Phenyl isocyanide, p-benzoyl-?
The molecular weight of Phenyl isocyanide, p-benzoyl- is 207.07 g/mol.
Where can I buy Phenyl isocyanide, p-benzoyl-?
You can request a quote for Phenyl isocyanide, p-benzoyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl isocyanide, p-benzoyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenyl isocyanide, p-benzoyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.