Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-
TL;DR: Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- (CAS 161395-29-5) is a chemical compound with molecular formula C13H20 and molecular weight 176.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7,7-trimethyl-4-prop-1-en-2-ylbicyclo[4.1.0]hept-3-ene
Also Known As: (+)-3-Carene, 4-isopropenyl-, (+)-3-Carene,4-isopropenyl, Bicyclo[4.1.0]hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-, 3,7,7-trimethyl-4-prop-1-en-2-ylbicyclo[4.1.0]hept-3-ene, 3-Isopropenyl-4,7,7-trimethylbicyclo[4.1.0]hept-3-ene #
| Molecular Formula | C13H20 |
|---|---|
| Molecular Weight | 176.16 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.1565 |
| Heavy Atoms | 13 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 161395-29-5 |
|---|---|
| SMILES | CC1=C(CC2C(C1)C2(C)C)C(=C)C |
| InChIKey | PVUBPUSDYAGBLW-UHFFFAOYSA-N |
Product Overview
Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- (CAS 161395-29-5), with molecular formula C13H20 and molecular weight 176.16 g/mol. IUPAC: 3,7,7-trimethyl-4-prop-1-en-2-ylbicyclo[4.1.0]hept-3-ene.
Chemical Property Profile of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-
Property Insights of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-
The XLogP value of 3.7 indicates that Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- 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(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-?
The CAS number of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- is 161395-29-5.
What is the molecular formula of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-?
The molecular formula of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- is C13H20.
What is the molecular weight of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-?
The molecular weight of Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- is 176.16 g/mol.
Where can I buy Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-?
You can request a quote for Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-4-(1-methylethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.