1,2-Dichloro-4-isocyanobenzene
TL;DR: 1,2-Dichloro-4-isocyanobenzene (CAS 1930-84-3) is a chemical compound with molecular formula C7H3Cl2N and molecular weight 170.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dichloro-4-isocyanobenzene
Also Known As: 1,2-dichloro-4-isocyanobenzene, 3,4-Dichlorophenylisocyanide, 3,4-dichlorophenyl isocyanide, 3,4-dichlorphenylisocyanide, 1,2-dichloro-4-isocyano-benzene
| Molecular Formula | C7H3Cl2N |
|---|---|
| Molecular Weight | 170.96 g/mol |
| LogP | 3.54419 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.96425 |
| Heavy Atoms | 10 |
| Complexity | 288.14786 |
Chemical Identifiers
| CAS Number | 1930-84-3 |
|---|---|
| SMILES | [C-]#[N+]C1=CC(=C(C=C1)Cl)Cl |
Product Overview
1,2-Dichloro-4-isocyanobenzene (CAS 1930-84-3), with molecular formula C7H3Cl2N and molecular weight 170.96 g/mol. IUPAC: 1,2-dichloro-4-isocyanobenzene.
Chemical Property Profile of 1,2-Dichloro-4-isocyanobenzene
Property Insights of 1,2-Dichloro-4-isocyanobenzene
The XLogP value of 3.54419 indicates that 1,2-Dichloro-4-isocyanobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.36 Ų, 1,2-Dichloro-4-isocyanobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dichloro-4-isocyanobenzene has 0 hydrogen bond donor(s) and 0 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 1,2-Dichloro-4-isocyanobenzene?
The CAS number of 1,2-Dichloro-4-isocyanobenzene is 1930-84-3.
What is the molecular formula of 1,2-Dichloro-4-isocyanobenzene?
The molecular formula of 1,2-Dichloro-4-isocyanobenzene is C7H3Cl2N.
What is the molecular weight of 1,2-Dichloro-4-isocyanobenzene?
The molecular weight of 1,2-Dichloro-4-isocyanobenzene is 170.96 g/mol.
Where can I buy 1,2-Dichloro-4-isocyanobenzene?
You can request a quote for 1,2-Dichloro-4-isocyanobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dichloro-4-isocyanobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dichloro-4-isocyanobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.