(2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene
TL;DR: (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene (CAS 53152-70-8) is a chemical compound with molecular formula C17H15N and molecular weight 233.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-isocyano-2-methyl-1-phenylcyclopropyl)benzene
Also Known As: (2-isocyano-2-methyl-1-phenylcyclopropyl)benzene, 1,1'-(2-Isocyano-2-methylcyclopropane-1,1-diyl)dibenzene
| Molecular Formula | C17H15N |
|---|---|
| Molecular Weight | 233.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.12045 |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 53152-70-8 |
|---|---|
| SMILES | CC1(CC1(C2=CC=CC=C2)C3=CC=CC=C3)[N+]#[C-] |
| InChIKey | GRVGYPCEXFWSSM-UHFFFAOYSA-N |
Product Overview
(2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene (CAS 53152-70-8), with molecular formula C17H15N and molecular weight 233.12 g/mol. IUPAC: (2-isocyano-2-methyl-1-phenylcyclopropyl)benzene.
Chemical Property Profile of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene
Property Insights of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene
The XLogP value of 3.7 indicates that (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.4 Ų, (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene 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 (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene?
The CAS number of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene is 53152-70-8.
What is the molecular formula of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene?
The molecular formula of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene is C17H15N.
What is the molecular weight of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene?
The molecular weight of (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene is 233.12 g/mol.
Where can I buy (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene?
You can request a quote for (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (2-Isocyano-2-methyl-1-phenylcyclopropyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.