3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen
TL;DR: 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen (CAS 7229-90-5) is a chemical compound with molecular formula C40H80Cd7N2O14-2 and molecular weight 1609.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cadmium;bis([3-[3-(dihydroxymethyl)cyclohexyl]cyclohexyl]methanediol);4-(2-piperidin-1-id-4-ylethenyl)-2H-pyridin-1-ide;hexahydrate
Also Known As: 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen
| Molecular Formula | C40H80Cd7N2O14-2 |
|---|---|
| Molecular Weight | 1609.88 g/mol |
| LogP | 0.6292 |
| Topological Polar Surface Area | 379.04 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 1609.8845 |
| Heavy Atoms | 63 |
| Complexity | 968.24554 |
Chemical Identifiers
| CAS Number | 7229-90-5 |
|---|---|
| SMILES | C1CC(CC(C1)C(O)O)C2CCCC(C2)C(O)O.C1CC(CC(C1)C(O)O)C2CCCC(C2)C(O)O.C1C[N-]CCC1C=CC2=CC[N-]C=C2.O.O.O.O.O.O.[Cd].[Cd].[Cd].[Cd].[Cd].[Cd].[Cd] |
Product Overview
3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen (CAS 7229-90-5), with molecular formula C40H80Cd7N2O14-2 and molecular weight 1609.88 g/mol. IUPAC: cadmium;bis([3-[3-(dihydroxymethyl)cyclohexyl]cyclohexyl]methanediol);4-(2-piperidin-1-id-4-ylethenyl)-2H-pyridin-1-ide;hexahydrate.
Chemical Property Profile of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen
Property Insights of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen
The XLogP value of 0.6292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen. The TPSA of 379.04 Ų indicates high polarity, suggesting 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen has 8 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen?
The CAS number of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen is 7229-90-5.
What is the molecular formula of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen?
The molecular formula of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen is C40H80Cd7N2O14-2.
What is the molecular weight of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen?
The molecular weight of 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen is 1609.88 g/mol.
Where can I buy 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen?
You can request a quote for 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dimethyl-1,2,3,4,4a,5,6,12b-octahydro-tetraphen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.