RefChem:119712
TL;DR: RefChem:119712 (CAS 68921-48-2) is a chemical compound with molecular formula C11H18O and molecular weight 166.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;formaldehyde
Also Known As: beta-Pinene, formaldehyde condensation product, C10-H16.C-H2-O, Bicyclo(3.1.1)heptane, 6,6-dimethyl-2-methylene-, reaction products with formaldehyde, Bicyclo[3.1.1]heptane, 6,6-dimethyl-2-methylene-, reaction products with formaldehyde, 6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane; formaldehyde
| Molecular Formula | C11H18O |
|---|---|
| Molecular Weight | 166.14 g/mol |
| LogP | 2.8138 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.13577 |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 68921-48-2 |
|---|---|
| SMILES | CC1(C2CCC(=C)C1C2)C.C=O |
| InChIKey | COXRCDRPZKPREC-UHFFFAOYSA-N |
Product Overview
RefChem:119712 (CAS 68921-48-2), with molecular formula C11H18O and molecular weight 166.14 g/mol. IUPAC: 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;formaldehyde.
Chemical Property Profile of RefChem:119712
Property Insights of RefChem:119712
The XLogP value of 2.8138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:119712. With a topological polar surface area (TPSA) of 17.1 Ų, RefChem:119712 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:119712 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 RefChem:119712?
The CAS number of RefChem:119712 is 68921-48-2.
What is the molecular formula of RefChem:119712?
The molecular formula of RefChem:119712 is C11H18O.
What is the molecular weight of RefChem:119712?
The molecular weight of RefChem:119712 is 166.14 g/mol.
Where can I buy RefChem:119712?
You can request a quote for RefChem:119712 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:119712?
Yes, KEHONG BIO provides custom synthesis services for RefChem:119712 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.