2-(Cyclopropylmethoxy)benzonitrile
TL;DR: 2-(Cyclopropylmethoxy)benzonitrile (CAS 83728-40-9) 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.
2-(cyclopropylmethoxy)benzonitrile
Also Known As: 2-(cyclopropylmethoxy)benzonitrile, Benzonitrile,2-(cyclopropylmethoxy)-, 2- BENZONITRILE, L-CYSTEINEHYDANTOIN, Benzonitrile, 2-(cyclopropylmethoxy)-
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 2.34708 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 336.18866 |
Chemical Identifiers
| CAS Number | 83728-40-9 |
|---|---|
| SMILES | C1CC1COC2=CC=CC=C2C#N |
Product Overview
2-(Cyclopropylmethoxy)benzonitrile (CAS 83728-40-9), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 2-(cyclopropylmethoxy)benzonitrile.
Chemical Property Profile of 2-(Cyclopropylmethoxy)benzonitrile
Property Insights of 2-(Cyclopropylmethoxy)benzonitrile
The XLogP value of 2.34708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Cyclopropylmethoxy)benzonitrile. With a topological polar surface area (TPSA) of 33.02 Ų, 2-(Cyclopropylmethoxy)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Cyclopropylmethoxy)benzonitrile 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 2-(Cyclopropylmethoxy)benzonitrile?
The CAS number of 2-(Cyclopropylmethoxy)benzonitrile is 83728-40-9.
What is the molecular formula of 2-(Cyclopropylmethoxy)benzonitrile?
The molecular formula of 2-(Cyclopropylmethoxy)benzonitrile is C11H11NO.
What is the molecular weight of 2-(Cyclopropylmethoxy)benzonitrile?
The molecular weight of 2-(Cyclopropylmethoxy)benzonitrile is 173.08 g/mol.
Where can I buy 2-(Cyclopropylmethoxy)benzonitrile?
You can request a quote for 2-(Cyclopropylmethoxy)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Cyclopropylmethoxy)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Cyclopropylmethoxy)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.