1,3-Dimethylbicyclo(1.1.0)butane
TL;DR: 1,3-Dimethylbicyclo(1.1.0)butane (CAS 930-25-6) is a chemical compound with molecular formula CC12CC1(C2)C and molecular weight 82.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethylbicyclo[1.1.0]butane
Also Known As: 1,3-Dimethylbicyclo[1.1.0]butane, 1,3-Dimethylbicyclo(1.1.0)butane, 1,3-Dimethylbicyclo<1.1.0>butan, RefChem:72723
| Molecular Formula | CC12CC1(C2)C |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 82.07825 |
| Heavy Atoms | 6 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 930-25-6 |
|---|---|
| SMILES | CC12CC1(C2)C |
| InChIKey | IGAOOQCFXPSZTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dimethylbicyclo(1.1.0)butane (CAS 930-25-6), with molecular formula CC12CC1(C2)C and molecular weight 82.08 g/mol. IUPAC: 1,3-dimethylbicyclo[1.1.0]butane.
Chemical Property Profile of 1,3-Dimethylbicyclo(1.1.0)butane
Property Insights of 1,3-Dimethylbicyclo(1.1.0)butane
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethylbicyclo(1.1.0)butane. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Dimethylbicyclo(1.1.0)butane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethylbicyclo(1.1.0)butane has 0 hydrogen bond donor(s) and 0 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 1,3-Dimethylbicyclo(1.1.0)butane?
The CAS number of 1,3-Dimethylbicyclo(1.1.0)butane is 930-25-6.
What is the molecular formula of 1,3-Dimethylbicyclo(1.1.0)butane?
The molecular formula of 1,3-Dimethylbicyclo(1.1.0)butane is CC12CC1(C2)C.
What is the molecular weight of 1,3-Dimethylbicyclo(1.1.0)butane?
The molecular weight of 1,3-Dimethylbicyclo(1.1.0)butane is 82.08 g/mol.
Where can I buy 1,3-Dimethylbicyclo(1.1.0)butane?
You can request a quote for 1,3-Dimethylbicyclo(1.1.0)butane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethylbicyclo(1.1.0)butane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethylbicyclo(1.1.0)butane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.