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CAS 106950-13-4 6-ETHYL-4-METHOXY-2-PYRANONE molecular structure lightbox
CAS RN: 106950-13-4

6-ETHYL-4-METHOXY-2-PYRANONE

Product Availability

Choose a grade to view its available package options.

5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250719 10g In stock Shenzhen Inquiry
Batchno.20250813 1g In stock Shenzhen Inquiry
Batchno.20250610 250mg Out of stock Inquiry
Batchno.20260209 250mg / 1g / 5g / 10g Out of stock 5-7 business days Inquiry
Batchno.20250412 5g In stock Shenzhen, Tianjin Inquiry
  • Product code: SSC-008435
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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: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 106950-13-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

106950-13-4 / 6-ethyl-4-methoxypyran-2-one

6-ETHYL-4-METHOXY-2-PYRANONE | DTXSID60455693 | RefChem:308270

Standard CAS: 106950-13-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
106950-13-4
Multi CAS
No
Molecular Formula
C8H10O3
Molecular Weight
154.160000
Exact Mass
154.062994
SMILES
CCC1=CC(=CC(=O)O1)OC
InChI
InChI=1S/C8H10O3/c1-3-6-4-7(10-2)5-8(9)11-6/h4-5H,3H2,1-2H3
InChIKey
CRYDMVQAZDVQSO-UHFFFAOYSA-N
Synonyms
6-ETHYL-4-METHOXY-2-PYRANONE DTXSID60455693 RefChem:308270 DTXCID90406512 6-Ethyl-4-methoxy-2H-pyran-2-one

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
40.91
TPSA
39.44

LogP / Solubility

WLOGP
1.21
MLOGP
1.06
XLogP3
1.3
Consensus LogP
1.19
Log S (ESOL)
-1.83
Class (ESOL)
Soluble
Log S (Ali)
-1.7
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.91
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.8

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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