3-Isocyanato-4-methoxybiphenyl
TL;DR: 3-Isocyanato-4-methoxybiphenyl (CAS 480439-22-3) is a chemical compound with molecular formula C14H11NO2 and molecular weight 225.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-isocyanato-1-methoxy-4-phenylbenzene
Also Known As: 3-Isocyanato-4-methoxybiphenyl, 2-Methoxy-5-phenylphenyl isocyanate, 2-isocyanato-1-methoxy-4-phenylbenzene, 1,1'-Biphenyl, 3-isocyanato-4-methoxy-, 3-Isocyanato-4-methoxybiphenyl, 97%
| Molecular Formula | C14H11NO2 |
|---|---|
| Molecular Weight | 225.08 g/mol |
| LogP | 3.3295 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.07898 |
| Heavy Atoms | 17 |
| Complexity | 557.6898 |
Chemical Identifiers
| CAS Number | 480439-22-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CC=CC=C2)N=C=O |
Product Overview
3-Isocyanato-4-methoxybiphenyl (CAS 480439-22-3), with molecular formula C14H11NO2 and molecular weight 225.08 g/mol. IUPAC: 2-isocyanato-1-methoxy-4-phenylbenzene.
Chemical Property Profile of 3-Isocyanato-4-methoxybiphenyl
Property Insights of 3-Isocyanato-4-methoxybiphenyl
The XLogP value of 3.3295 indicates that 3-Isocyanato-4-methoxybiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, 3-Isocyanato-4-methoxybiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isocyanato-4-methoxybiphenyl has 0 hydrogen bond donor(s) and 3 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 3-Isocyanato-4-methoxybiphenyl?
The CAS number of 3-Isocyanato-4-methoxybiphenyl is 480439-22-3.
What is the molecular formula of 3-Isocyanato-4-methoxybiphenyl?
The molecular formula of 3-Isocyanato-4-methoxybiphenyl is C14H11NO2.
What is the molecular weight of 3-Isocyanato-4-methoxybiphenyl?
The molecular weight of 3-Isocyanato-4-methoxybiphenyl is 225.08 g/mol.
Where can I buy 3-Isocyanato-4-methoxybiphenyl?
You can request a quote for 3-Isocyanato-4-methoxybiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isocyanato-4-methoxybiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 3-Isocyanato-4-methoxybiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.