10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]
TL;DR: 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] (CAS 57090-63-8) is a chemical compound with molecular formula C30H48F2O2 and molecular weight 478.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8',8'-difluoro-2',16'-dimethyl-15'-(6-methylheptan-2-yl)spiro[1,3-dioxolane-2,5'-pentacyclo[9.7.0.02,7.07,9.012,16]octadecane]
Also Known As: 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane], 8',8'-Difluoro-2',16'-dimethyl-15'-(6-methylheptan-2-yl)spiro[1,3-dioxolane-2,5'-pentacyclo[9.7.0.02,7.07,9.012,16]octadecane]
| Molecular Formula | C30H48F2O2 |
|---|---|
| Molecular Weight | 478.36 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 478.36224 |
| Heavy Atoms | 34 |
| Complexity | 806.0 |
Chemical Identifiers
| CAS Number | 57090-63-8 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC4C5(C3(CCC6(C5)OCCO6)C)C4(F)F)C |
| InChIKey | XHEDVTDRSKFARV-UHFFFAOYSA-N |
Product Overview
10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] (CAS 57090-63-8), with molecular formula C30H48F2O2 and molecular weight 478.36 g/mol. IUPAC: 8',8'-difluoro-2',16'-dimethyl-15'-(6-methylheptan-2-yl)spiro[1,3-dioxolane-2,5'-pentacyclo[9.7.0.02,7.07,9.012,16]octadecane].
Chemical Property Profile of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]
Property Insights of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]
The XLogP value of 9.3 indicates that 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]?
The CAS number of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] is 57090-63-8.
What is the molecular formula of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]?
The molecular formula of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] is C30H48F2O2.
What is the molecular weight of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]?
The molecular weight of 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] is 478.36 g/mol.
Where can I buy 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]?
You can request a quote for 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane]?
Yes, KEHONG BIO provides custom synthesis services for 10,10-Difluoro-3a,5b-dimethyl-3-(6-methylheptan-2-yl)tetradecahydro-1H,9H-spiro[cyclopenta[a]cyclopropa[k]phenanthrene-8,2'-[1,3]dioxolane] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.