CAS RN: 114205-89-9
9,9-Bis(4-glycidyloxy-3-methylphenyl)fluorene
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250723 | 200mg / 1g / 5g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-014063
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
114205-89-9 / 2-[[2-methyl-4-[9-[3-methyl-4-(oxiran-2-ylmethoxy)phenyl]fluoren-9-yl]phenoxy]methyl]oxirane
DTXSID90603145 | 2,2'-(9H-Fluorene-9,9-diylbis((2-methyl-4,1-phenylene)oxymethylene))bis(oxirane) | 2,2'-{9H-Fluorene-9,9-diylbis[(2-methyl-4,1-phenylene)oxymethylene]}bis(oxirane)
Basic Information
CAS
114205-89-9
Multi CAS
No
Molecular Formula
C33H30O4
Molecular Weight
490.600000
Exact Mass
490.214409
SMILES
CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC(=C(C=C5)OCC6CO6)C)OCC7CO7
InChI
InChI=1S/C33H30O4/c1-21-15-23(11-13-31(21)36-19-25-17-34-25)33(24-12-14-32(22(2)16-24)37-20-26-18-35-26)29-9-5-3-7-27(29)28-8-4-6-10-30(28)33/h3-16,25-26H,17-20H2,1-2H3
InChIKey
ABXGZTBEQZOCEE-UHFFFAOYSA-N
Synonyms
DTXSID90603145
2,2'-(9H-Fluorene-9,9-diylbis((2-methyl-4,1-phenylene)oxymethylene))bis(oxirane)
2,2'-{9H-Fluorene-9,9-diylbis[(2-methyl-4,1-phenylene)oxymethylene]}bis(oxirane)
RefChem:1058859
DTXCID20553902
Computed Properties
Structural Parameters
Heavy atom count
37
Aromatic heavy atom count
24
Fraction Csp3
0.27
Rotatable bonds
8
H-bond acceptors
4
Molar refractivity
143.69
TPSA
43.52
LogP / Solubility
WLOGP
6.22
MLOGP
5.51
XLogP3
6.7
Consensus LogP
6.14
Log S (ESOL)
-6.75
Class (ESOL)
Insoluble
Log S (Ali)
-8.08
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.97
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7
