![[(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile structure](/static/products/518/518314-72-2.png)
[(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile
TL;DR: [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile (CAS 518314-72-2) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2E)-2-hydroxyimino-1,7-dimethyl-7-bicyclo[2.2.1]heptanyl]acetonitrile
Also Known As: [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 2.55658 |
| Topological Polar Surface Area | 56.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 330.66946 |
Chemical Identifiers
| CAS Number | 518314-72-2 |
|---|---|
| SMILES | CC1\2CCC(C1(C)CC#N)C/C2=N\O |
Product Overview
[(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile (CAS 518314-72-2), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: 2-[(2E)-2-hydroxyimino-1,7-dimethyl-7-bicyclo[2.2.1]heptanyl]acetonitrile.
Chemical Property Profile of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile
Property Insights of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile
The XLogP value of 2.55658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile. With a topological polar surface area (TPSA) of 56.38 Ų, [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile has 1 hydrogen bond donor(s) and 3 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 [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile?
The CAS number of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile is 518314-72-2.
What is the molecular formula of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile?
The molecular formula of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile is C11H16N2O.
What is the molecular weight of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile?
The molecular weight of [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile is 192.13 g/mol.
Where can I buy [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile?
You can request a quote for [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for [(2E)-2-(hydroxyimino)-1,7-dimethylbicyclo[2.2.1]hept-7-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.