3-亚甲基环丁腈
TL;DR: 3-亚甲基环丁腈 (CAS 15760-35-7) is a chemical compound with molecular formula C6H7N and molecular weight 93.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-亚甲基环丁腈
3-methylidenecyclobutane-1-carbonitrile
Also Known As: 3-Methylenecyclobutanecarbonitrile, 3-methylidenecyclobutane-1-carbonitrile, 3-Methylenecyclobutane-1-carbonitrile, 3-Methylenecyanocyclobutane, 3-Methylene-1-cyanocyclobutane
| Molecular Formula | C6H7N |
|---|---|
| Molecular Weight | 93.06 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 93.057846 |
| Heavy Atoms | 7 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 15760-35-7 |
|---|---|
| SMILES | C=C1CC(C1)C#N |
| InChIKey | ZRWMAMOBIQQJSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-亚甲基环丁腈 (CAS 15760-35-7), with molecular formula C6H7N and molecular weight 93.06 g/mol. IUPAC: 3-methylidenecyclobutane-1-carbonitrile.
Chemical Property Profile of 3-亚甲基环丁腈
Property Insights of 3-亚甲基环丁腈
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-亚甲基环丁腈. With a topological polar surface area (TPSA) of 23.8 Ų, 3-亚甲基环丁腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-亚甲基环丁腈 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 3-亚甲基环丁腈?
The CAS number of 3-亚甲基环丁腈 is 15760-35-7.
What is the molecular formula of 3-亚甲基环丁腈?
The molecular formula of 3-亚甲基环丁腈 is C6H7N.
What is the molecular weight of 3-亚甲基环丁腈?
The molecular weight of 3-亚甲基环丁腈 is 93.06 g/mol.
Where can I buy 3-亚甲基环丁腈?
You can request a quote for 3-亚甲基环丁腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-亚甲基环丁腈?
Yes, KEHONG BIO provides custom synthesis services for 3-亚甲基环丁腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.