1-(4-甲氧基苯基)环丙烷-1-甲腈
TL;DR: 1-(4-甲氧基苯基)环丙烷-1-甲腈 (CAS 16728-00-0) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-甲氧基苯基)环丙烷-1-甲腈
1-(4-methoxyphenyl)cyclopropane-1-carbonitrile
Also Known As: 1-(4-methoxyphenyl)cyclopropanecarbonitrile, 1-(4-Methoxyphenyl)cyclopropane-1-carbonitrile, 4-(1-Cyanocyclopropyl)anisole, CYCLOPROPANECARBONITRILE, 1-(4-METHOXYPHENYL)-, 1-(4-methoxy-phenyl)-cyclopropanecarbonitrile
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 16728-00-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2(CC2)C#N |
| InChIKey | OIQRGAQXQLASRC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-甲氧基苯基)环丙烷-1-甲腈 (CAS 16728-00-0), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 1-(4-methoxyphenyl)cyclopropane-1-carbonitrile.
Chemical Property Profile of 1-(4-甲氧基苯基)环丙烷-1-甲腈
Property Insights of 1-(4-甲氧基苯基)环丙烷-1-甲腈
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-甲氧基苯基)环丙烷-1-甲腈. With a topological polar surface area (TPSA) of 33.0 Ų, 1-(4-甲氧基苯基)环丙烷-1-甲腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-甲氧基苯基)环丙烷-1-甲腈 has 0 hydrogen bond donor(s) and 2 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-(4-甲氧基苯基)环丙烷-1-甲腈?
The CAS number of 1-(4-甲氧基苯基)环丙烷-1-甲腈 is 16728-00-0.
What is the molecular formula of 1-(4-甲氧基苯基)环丙烷-1-甲腈?
The molecular formula of 1-(4-甲氧基苯基)环丙烷-1-甲腈 is C11H11NO.
What is the molecular weight of 1-(4-甲氧基苯基)环丙烷-1-甲腈?
The molecular weight of 1-(4-甲氧基苯基)环丙烷-1-甲腈 is 173.08 g/mol.
Where can I buy 1-(4-甲氧基苯基)环丙烷-1-甲腈?
You can request a quote for 1-(4-甲氧基苯基)环丙烷-1-甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-甲氧基苯基)环丙烷-1-甲腈?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-甲氧基苯基)环丙烷-1-甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.