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CAS 356-36-5 Dimethyl Tetrafluorosuccinate molecular structure lightbox
CAS RN: 356-36-5

Dimethyl Tetrafluorosuccinate

  • Product code: SSC-142622
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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: 1g
  • Available purity: ≥95%
  • 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 356-36-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

356-36-5 / dimethyl 2,2,3,3-tetrafluorobutanedioate

Standard CAS: 356-36-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
356-36-5
Multi CAS
Yes
Molecular Formula
C6F4H6O4
Molecular Weight
218.100000
Exact Mass
218.020221
InChI
InChI=1S/C6H6F4O4/c1-13-3(11)5(7,8)6(9,10)4(12)14-2/h1-2H3
InChIKey
RMXAYQBUNVSEPG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.67
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
33.93
TPSA
52.6

LogP / Solubility

WLOGP
0.6
MLOGP
0.53
XLogP3
1.4
Consensus LogP
0.84
Log S (ESOL)
-1.37
Class (ESOL)
Soluble
Log S (Ali)
-1.78
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
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)
-3.62

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

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