瞬烯
TL;DR: 瞬烯 (CAS 1005-51-2) is a chemical compound with molecular formula C1=CC2C3C2C=CC1C=C3 and molecular weight 130.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
瞬烯
tricyclo[3.3.2.02,8]deca-3,6,9-triene
Also Known As: Bullvalene, Bullvalen, BULLVALENE [MI], Tricyclo[3.3.2.02,8]deca-3,6,9-triene, BULLVALENE (C10H10)
| Molecular Formula | C1=CC2C3C2C=CC1C=C3 |
|---|---|
| Molecular Weight | 130.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.07825 |
| Heavy Atoms | 10 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 1005-51-2 |
|---|---|
| SMILES | C1=CC2C3C2C=CC1C=C3 |
| InChIKey | UKFBVTJTKMSPMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
瞬烯 (CAS 1005-51-2), with molecular formula C1=CC2C3C2C=CC1C=C3 and molecular weight 130.08 g/mol. IUPAC: tricyclo[3.3.2.02,8]deca-3,6,9-triene.
Chemical Property Profile of 瞬烯
Property Insights of 瞬烯
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 瞬烯. With a topological polar surface area (TPSA) of 0.0 Ų, 瞬烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 瞬烯 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 瞬烯?
The CAS number of 瞬烯 is 1005-51-2.
What is the molecular formula of 瞬烯?
The molecular formula of 瞬烯 is C1=CC2C3C2C=CC1C=C3.
What is the molecular weight of 瞬烯?
The molecular weight of 瞬烯 is 130.08 g/mol.
Where can I buy 瞬烯?
You can request a quote for 瞬烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 瞬烯?
Yes, KEHONG BIO provides custom synthesis services for 瞬烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.