CAS RN: 23866-72-0
ETHYL 7-HYDROXY-4-OXO-4H-CHROMENE-2-CARBOXYLATE
Product Availability
Choose a grade to view its available package options.
5 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250824 | 100mg | Out of stock | Inquiry | ||
| Batchno.20250929 | 1g | Out of stock | Inquiry | ||
| Batchno.20250718 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250626 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
| Batchno.20260205 | 5g | Out of stock | Inquiry |
- Product code: SSC-116529
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: ＞97%
- 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 | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
23866-72-0 / ethyl 7-hydroxy-4-oxochromene-2-carboxylate
Basic Information
CAS
23866-72-0
Multi CAS
No
Molecular Formula
C12H10O5
Molecular Weight
234.200000
Exact Mass
234.052823
SMILES
CCOC(=O)C1=CC(=O)C2=C(O1)C=C(C=C2)O
InChI
InChI=1S/C12H10O5/c1-2-16-12(15)11-6-9(14)8-4-3-7(13)5-10(8)17-11/h3-6,13H,2H2,1H3
InChIKey
RKIMFICEWCXBCE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
10
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
60.11
TPSA
76.74
LogP / Solubility
WLOGP
1.68
MLOGP
1.48
XLogP3
2.4
Consensus LogP
1.85
Log S (ESOL)
-2.65
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.69
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.81
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.96
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
3,4-Epoxycyclohexylmethyl 3,4-epoxycyclohexanecarboxylate
- CAS RN: 2386-87-0
- Product Code: SSC-116463
-
-
-
-
