CAS RN: 3934-23-4

1H,1H-PERFLUOROOCTYL METHACRYLATE

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4 package records4 with current stock2 grade groups
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Batchno.20250501 1g In stock Inquiry
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  • Product code: starshine_CAS3934-23-4
  • Purity/Analytical Methods: >99.0%
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3934-23-4 / 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl 2-methylprop-2-enoate

Standard CAS: 3934-23-4 Multi CAS: Yes

Basic Information

CAS
3934-23-4
Multi CAS
Yes
Molecular Formula
C12F15H7O2
Molecular Weight
468.160000
Exact Mass
468.020652
InChI
InChI=1S/C12H7F15O2/c1-4(2)5(28)29-3-6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)11(23,24)12(25,26)27/h1,3H2,2H3
InChIKey
RUEKTOVLVIXOHT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Fraction Csp3
0.75
Rotatable bonds
8
H-bond acceptors
2
Molar refractivity
61.51
TPSA
26.3

LogP / Solubility

WLOGP
5.48
MLOGP
4.85
XLogP3
6.2
Consensus LogP
5.51
Log S (ESOL)
-5.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.36
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.21
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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