[email protected]
CAS 97986-34-0 Oxan-4-yl 4-methylbenzenesulfonate molecular structure lightbox
CAS RN: 97986-34-0

Oxan-4-yl 4-methylbenzenesulfonate

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250424 100mg In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250419 1g In stock Shanghai Inquiry
Batchno.20251223 250mg In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260101 250mg / 500mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batchno.20260323 25g In stock Shanghai Inquiry
Batchno.20250522 5g Out of stock Inquiry
  • Product code: SSC-212428
GET A QUOTE
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
Request Bulk Quote

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 97986-34-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

97986-34-0 / oxan-4-yl 4-methylbenzenesulfonate

Standard CAS: 97986-34-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
97986-34-0
Multi CAS
Yes
Molecular Formula
C12H16O4S
Molecular Weight
256.320000
Exact Mass
256.076930
InChI
InChI=1S/C12H16O4S/c1-10-2-4-12(5-3-10)17(13,14)16-11-6-8-15-9-7-11/h2-5,11H,6-9H2,1H3
InChIKey
ZEERHWXRRLRIQO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
63.29
TPSA
52.6

LogP / Solubility

WLOGP
1.88
MLOGP
1.66
XLogP3
2
Consensus LogP
1.85
Log S (ESOL)
-2.68
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.02
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.25
Class (SILICOS-IT)
Poorly 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)
-2.95

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us