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CAS 6792-31-0 Hexafluoropropene trimer molecular structure lightbox
CAS RN: 6792-31-0

Hexafluoropropene trimer

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7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260429 100g In stock Inquiry
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Batchno.20251005 100g In stock Shanghai Inquiry
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  • Product code: LINH896040
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6792-31-0 / 1,1,2,3,3,3-hexafluoroprop-1-ene

Standard CAS: 6792-31-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6792-31-0
Multi CAS
Yes
Molecular Formula
C9F18
Molecular Weight
450.070000
Exact Mass
449.971257
InChI
InChI=1S/3C3F6/c3*4-1(2(5)6)3(7,8)9
InChIKey
VJRSWIKVCUMTFK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Fraction Csp3
0.33
H-bond acceptors
18
Molar refractivity
49.21
TPSA
0.0000

LogP / Solubility

WLOGP
7.88
MLOGP
6.96
XLogP3
7.88
Consensus LogP
7.57
Log S (ESOL)
-7.59
Class (ESOL)
Insoluble
Log S (Ali)
-8.94
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.12
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
0.13

Drug-likeness / Medicinal Chemistry

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

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