((1R)-1-Isocyanoethyl)benzene
TL;DR: ((1R)-1-Isocyanoethyl)benzene (CAS 17329-20-3) is a chemical compound with molecular formula C9H9N and molecular weight 131.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R)-1-isocyanoethyl]benzene
Also Known As: [(1R)-1-isocyanoethyl]benzene|1-isocyanoethylbenzene|D-a-methylbenzylisocyanide|(R)-(1-isocyanoethyl)benzene|((1R)-1-Isocyanoethyl)benzene|d-(+)-alpha-methylbenzylisocyanide|(R)-alpha-Methylbenzyl isocyanide|D-(+)- -Methylbenzylisocyanide|(r)-(+)-1-phenylethylisocyanide|(S)(-)-|A-methylbenzylisonitrile|D-(+)-Alpha-Methyl-Benzylisocyanide|D-(+)- alpha -Methylbenzylisocyanide|(S)-( C)-|A-methylbenzyl isocyanide|[R,(+)]-alpha-Methylbenzyl isocyanide|RefChem:203539|EN300-6512464
| Molecular Formula | C9H9N |
|---|---|
| Molecular Weight | 131.07 g/mol |
| LogP | 2.66689 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.0735 |
| Heavy Atoms | 10 |
| Complexity | 232.65523 |
Chemical Identifiers
| CAS Number | 17329-20-3 |
|---|---|
| SMILES | C[C@H](C1=CC=CC=C1)[N+]#[C-] |
Product Overview
((1R)-1-Isocyanoethyl)benzene (CAS 17329-20-3), with molecular formula C9H9N and molecular weight 131.07 g/mol. IUPAC: [(1R)-1-isocyanoethyl]benzene.
Chemical Property Profile of ((1R)-1-Isocyanoethyl)benzene
Property Insights of ((1R)-1-Isocyanoethyl)benzene
The XLogP value of 2.66689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((1R)-1-Isocyanoethyl)benzene. With a topological polar surface area (TPSA) of 4.36 Ų, ((1R)-1-Isocyanoethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((1R)-1-Isocyanoethyl)benzene 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 ((1R)-1-Isocyanoethyl)benzene?
The CAS number of ((1R)-1-Isocyanoethyl)benzene is 17329-20-3.
What is the molecular formula of ((1R)-1-Isocyanoethyl)benzene?
The molecular formula of ((1R)-1-Isocyanoethyl)benzene is C9H9N.
What is the molecular weight of ((1R)-1-Isocyanoethyl)benzene?
The molecular weight of ((1R)-1-Isocyanoethyl)benzene is 131.07 g/mol.
Where can I buy ((1R)-1-Isocyanoethyl)benzene?
You can request a quote for ((1R)-1-Isocyanoethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((1R)-1-Isocyanoethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for ((1R)-1-Isocyanoethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.