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CAS 124898-13-1 Trimethyl(pentafluoroethyl)silane molecular structure lightbox
CAS RN: 124898-13-1

Trimethyl(pentafluoroethyl)silane

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260630 10g In stock Shanghai Inquiry
Batchno.20251229 1g In stock Shanghai Inquiry
Batchno.20250419 250mg In stock Shanghai Inquiry
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Batchno.20250218 5g In stock Shanghai Inquiry
  • Product code: ICTT3011
  • Purity/Analytical Methods: >98.0%(GC)
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124898-13-1 / trimethyl(1,1,2,2,2-pentafluoroethyl)silane

Standard CAS: 124898-13-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
124898-13-1
Multi CAS
No
Molecular Formula
C5H9F5Si
Molecular Weight
192.200000
Exact Mass
192.039368
SMILES
C[Si](C)(C)C(C(F)(F)F)(F)F
InChI
InChI=1S/C5H9F5Si/c1-11(2,3)5(9,10)4(6,7)8/h1-3H3
InChIKey
MTPVUVINMAGMJL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
5
Molar refractivity
34.35
TPSA
0.0000

LogP / Solubility

WLOGP
3.06
MLOGP
2.69
XLogP3
3.06
Consensus LogP
2.94
Log S (ESOL)
-2.89
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.35
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.57
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)
-1.72

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Flammable Irritant
Signal
Danger
GHS Hazard Statements
H224 (41.7%): Extremely flammable liquid and vapor [Danger Flammable liquids] H225 (33.3%): Highly Flammable liquid and vapor [Danger Flammable liquids] H226 (16.7%): Flammable liquid and vapor [Warning Flammable liquids] H315 (83.3%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501

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