Butecort
TL;DR: Butecort (CAS 5098-16-8) is a chemical compound with molecular formula C30H40F2O7 and molecular weight 550.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1S,2S,4S,8S,9S,11S,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3,3-dimethylbutanoate
Also Known As: Butecort, Fluocinolone acetonide t-butylacetic ester, 2-[(4as,5s,6as,6bs,9as,10as,10bs,12s)-4b,12-difluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl]-2-oxoethyl 3,3-dimethylbutanoate, [2-[(1S,2S,4S,8S,9S,11S,13S,19S)-12,19-Difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3,3-dimethylbutanoate, 2-(4b,12-Difluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl 3,3-dimethylbutanoate
| Molecular Formula | C30H40F2O7 |
|---|---|
| Molecular Weight | 550.27 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 550.27423 |
| Heavy Atoms | 39 |
| Complexity | 1170.0 |
Chemical Identifiers
| CAS Number | 5098-16-8 |
|---|---|
| SMILES | C[C@]12C[C@@H](C3([C@H]([C@@H]1C[C@H]4[C@]2(OC(O4)(C)C)C(=O)COC(=O)CC(C)(C)C)C[C@@H](C5=CC(=O)C=C[C@@]53C)F)F)O |
| InChIKey | ABYHIIVPZPOTTD-NBEGQRIYSA-N |
Product Overview
Butecort (CAS 5098-16-8), with molecular formula C30H40F2O7 and molecular weight 550.27 g/mol. IUPAC: [2-[(1S,2S,4S,8S,9S,11S,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3,3-dimethylbutanoate.
Chemical Property Profile of Butecort
Property Insights of Butecort
The XLogP value of 4.8 indicates that Butecort is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Butecort. Following Lipinski's Rule of Five, Butecort has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butecort?
The CAS number of Butecort is 5098-16-8.
What is the molecular formula of Butecort?
The molecular formula of Butecort is C30H40F2O7.
What is the molecular weight of Butecort?
The molecular weight of Butecort is 550.27 g/mol.
Where can I buy Butecort?
You can request a quote for Butecort directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butecort?
Yes, KEHONG BIO provides custom synthesis services for Butecort and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.