![异氰酸苯并[a]蒽-7-酯 structure](/static/products/6301/63018-56-4.webp)
异氰酸苯并[a]蒽-7-酯
TL;DR: 异氰酸苯并[a]蒽-7-酯 (CAS 63018-56-4) is a chemical compound with molecular formula C19H11NO and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异氰酸苯并[a]蒽-7-酯
7-isocyanatobenzo[a]anthracene
Also Known As: 7-isocyanatotetraphene, 1,2-Benzanthryl-10-isocyanate, 7-isocyanatobenzo[a]anthracene, Benz[a]anthracen-7-yl isocyanate, Benz[a]anthracene, 7-isocyanato-
| Molecular Formula | C19H11NO |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.08408 |
| Heavy Atoms | 21 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 63018-56-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)N=C=O |
| InChIKey | BRJLEUWFODMJNL-UHFFFAOYSA-N |
Product Overview
异氰酸苯并[a]蒽-7-酯 (CAS 63018-56-4), with molecular formula C19H11NO and molecular weight 269.08 g/mol. IUPAC: 7-isocyanatobenzo[a]anthracene.
Chemical Property Profile of 异氰酸苯并[a]蒽-7-酯
Property Insights of 异氰酸苯并[a]蒽-7-酯
The XLogP value of 6.5 indicates that 异氰酸苯并(a)蒽-7-酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.4 Ų, 异氰酸苯并[a]蒽-7-酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异氰酸苯并(a)蒽-7-酯 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 异氰酸苯并(a)蒽-7-酯?
The CAS number of 异氰酸苯并(a)蒽-7-酯 is 63018-56-4.
What is the molecular formula of 异氰酸苯并(a)蒽-7-酯?
The molecular formula of 异氰酸苯并(a)蒽-7-酯 is C19H11NO.
What is the molecular weight of 异氰酸苯并(a)蒽-7-酯?
The molecular weight of 异氰酸苯并(a)蒽-7-酯 is 269.08 g/mol.
Where can I buy 异氰酸苯并(a)蒽-7-酯?
You can request a quote for 异氰酸苯并(a)蒽-7-酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异氰酸苯并(a)蒽-7-酯?
Yes, KEHONG BIO provides custom synthesis services for 异氰酸苯并(a)蒽-7-酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.