Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-
TL;DR: Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- (CAS 4889-83-2) is a chemical compound with molecular formula C10H16 and molecular weight 136.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6,6-trimethylbicyclo[3.1.1]hept-2-ene
Also Known As: Orthodene, 3-Methyl-apopinene, ALPHA-PINENE, 2-Norpinene, 3,6,6-trimethyl-, 3-Methyl-2-apopinene
| Molecular Formula | C10H16 |
|---|---|
| Molecular Weight | 136.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.1252 |
| Heavy Atoms | 10 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 4889-83-2 |
|---|---|
| SMILES | CC1=CC2CC(C1)C2(C)C |
| InChIKey | ZJUDTXCEVUJEOX-UHFFFAOYSA-N |
Product Overview
Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- (CAS 4889-83-2), with molecular formula C10H16 and molecular weight 136.13 g/mol. IUPAC: 3,6,6-trimethylbicyclo[3.1.1]hept-2-ene.
Chemical Property Profile of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-
Property Insights of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- 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 Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-?
The CAS number of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- is 4889-83-2.
What is the molecular formula of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-?
The molecular formula of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- is C10H16.
What is the molecular weight of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-?
The molecular weight of Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- is 136.13 g/mol.
Where can I buy Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-?
You can request a quote for Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo(3.1.1)hept-2-ene, 3,6,6-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.