dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one
TL;DR: dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one (CAS 113062-80-9) is a chemical compound with molecular formula C19H28O3 and molecular weight 304.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6a,9,9-tetramethyl-1,2,5,6,7,7a,10a,11,11a,11b-decahydrophenanthro[2,3-d][1,3]dioxol-3-one
Also Known As: dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one, 4,6a,9,9-tetramethyl-1,2,5,6,7,7a,10a,11,11a,11b-decahydrophenanthro[2,3-d][1,3]dioxol-3-one, 4,6a,9,9-tetramethyl-1,5,6,6a,7,7a,10a,11,11a,11b-decahydrophenanthro[2,3-d][1,3]dioxol-3(2H)-one
| Molecular Formula | C19H28O3 |
|---|---|
| Molecular Weight | 304.20 g/mol |
| LogP | 4.0122 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.20386 |
| Heavy Atoms | 22 |
| Complexity | 546.88354 |
Chemical Identifiers
| CAS Number | 113062-80-9 |
|---|---|
| SMILES | CC1=C2CCC3(CC4C(CC3C2CCC1=O)OC(O4)(C)C)C |
Product Overview
dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one (CAS 113062-80-9), with molecular formula C19H28O3 and molecular weight 304.20 g/mol. IUPAC: 4,6a,9,9-tetramethyl-1,2,5,6,7,7a,10a,11,11a,11b-decahydrophenanthro[2,3-d][1,3]dioxol-3-one.
Chemical Property Profile of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one
Property Insights of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one
The XLogP value of 4.0122 indicates that dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one has 0 hydrogen bond donor(s) and 3 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 dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one?
The CAS number of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one is 113062-80-9.
What is the molecular formula of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one?
The molecular formula of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one is C19H28O3.
What is the molecular weight of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one?
The molecular weight of dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one is 304.20 g/mol.
Where can I buy dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one?
You can request a quote for dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one?
Yes, KEHONG BIO provides custom synthesis services for dodecahydro-4,6a,9,9-tetramethylphenanthro(2,3-d)(1,3)dioxol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.