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1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile
TL;DR: 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile (CAS 74764-53-7) is a chemical compound with molecular formula C10H12N2 and molecular weight 160.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile
Also Known As: 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile, Bicyclo[4.1.0]heptane-7,7-dicarbonitrile, 1-methyl-, 6-methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile, 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile #
| Molecular Formula | C10H12N2 |
|---|---|
| Molecular Weight | 160.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.10005 |
| Heavy Atoms | 12 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 74764-53-7 |
|---|---|
| SMILES | CC12CCCCC1C2(C#N)C#N |
| InChIKey | TYJLWZPRKJYGNN-UHFFFAOYSA-N |
Product Overview
1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile (CAS 74764-53-7), with molecular formula C10H12N2 and molecular weight 160.10 g/mol. IUPAC: 1-methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile.
Chemical Property Profile of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile
Property Insights of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile. With a topological polar surface area (TPSA) of 47.6 Ų, 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile 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-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile?
The CAS number of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile is 74764-53-7.
What is the molecular formula of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile?
The molecular formula of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile is C10H12N2.
What is the molecular weight of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile?
The molecular weight of 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile is 160.10 g/mol.
Where can I buy 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile?
You can request a quote for 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylbicyclo[4.1.0]heptane-7,7-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.