beta-Retinyl sulfone
TL;DR: beta-Retinyl sulfone (CAS 58970-49-3) is a chemical compound with molecular formula C40H58O2S and molecular weight 602.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1E,3E,5E,7E)-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl]sulfonyl-3,7-dimethylnona-1,3,5,7-tetraenyl]-1,3,3-trimethylcyclohexene
Also Known As: beta-Retinyl sulfone, 2-[(1E,3E,5E,7E)-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl]sulfonyl-3,7-dimethylnona-1,3,5,7-tetraenyl]-1,3,3-trimethylcyclohexene, Cyclohexene, 1,1'-(sulfonylbis(3,7-dimethyl-1,3,5,7-nonatetraene-9,1-diyl)bis(2,6,6-trimethyl-, (all-E)-
| Molecular Formula | C40H58O2S |
|---|---|
| Molecular Weight | 602.42 g/mol |
| LogP | 11.4644 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 602.4158 |
| Heavy Atoms | 43 |
| Complexity | 1301.9165 |
Chemical Identifiers
| CAS Number | 58970-49-3 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/CS(=O)(=O)C/C=C(/C=C/C=C(/C=C/C2=C(CCCC2(C)C)C)\C)\C)/C)/C |
Product Overview
beta-Retinyl sulfone (CAS 58970-49-3), with molecular formula C40H58O2S and molecular weight 602.42 g/mol. IUPAC: 2-[(1E,3E,5E,7E)-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl]sulfonyl-3,7-dimethylnona-1,3,5,7-tetraenyl]-1,3,3-trimethylcyclohexene.
Chemical Property Profile of beta-Retinyl sulfone
Property Insights of beta-Retinyl sulfone
The XLogP value of 11.4644 indicates that beta-Retinyl sulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, beta-Retinyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Retinyl sulfone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-Retinyl sulfone?
The CAS number of beta-Retinyl sulfone is 58970-49-3.
What is the molecular formula of beta-Retinyl sulfone?
The molecular formula of beta-Retinyl sulfone is C40H58O2S.
What is the molecular weight of beta-Retinyl sulfone?
The molecular weight of beta-Retinyl sulfone is 602.42 g/mol.
Where can I buy beta-Retinyl sulfone?
You can request a quote for beta-Retinyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Retinyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for beta-Retinyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.