[email protected]
CAS 94767-47-2 2,2,3,3-TETRAFLUOROBENZODIOXENE molecular structure lightbox
CAS RN: 94767-47-2

2,2,3,3-TETRAFLUOROBENZODIOXENE

  • Product code: SSC-209965
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 94767-47-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

94767-47-2 / 2,2,3,3-tetrafluoro-1,4-benzodioxine

Standard CAS: 94767-47-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
94767-47-2
Multi CAS
Yes
Molecular Formula
C8F4H4O2
Molecular Weight
208.110000
Exact Mass
208.014742
InChI
InChI=1S/C8H4F4O2/c9-7(10)8(11,12)14-6-4-2-1-3-5(6)13-7/h1-4H
InChIKey
QLCDBPBUHSKXHY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
2
Molar refractivity
37.59
TPSA
18.46

LogP / Solubility

WLOGP
2.64
MLOGP
2.33
XLogP3
3.2
Consensus LogP
2.72
Log S (ESOL)
-3.11
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.18
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.21
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)
-2.11

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us