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CAS 27703-88-4 3-(3,3,3-TRIFLUOROPROPYL)HEPTAMETHYLTRISILOXANE molecular structure lightbox
CAS RN: 27703-88-4

3-(3,3,3-TRIFLUOROPROPYL)HEPTAMETHYLTRISILOXANE

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Batchno.20260412 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS27703-88-4
  • Purity/Analytical Methods: >99.0%
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27703-88-4 / trimethyl-[methyl-(3,3,3-trifluoropropyl)-trimethylsilyloxysilyl]oxysilane

Standard CAS: 27703-88-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
27703-88-4
Multi CAS
No
Molecular Formula
C10H25F3O2Si3
Molecular Weight
318.550000
Exact Mass
318.111444
InChI
InChI=1S/C10H25F3O2Si3/c1-16(2,3)14-18(7,15-17(4,5)6)9-8-10(11,12)13/h8-9H2,1-7H3
InChIKey
SVWGMNVDRHEOQI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
2
Molar refractivity
75.96
TPSA
18.46

LogP / Solubility

WLOGP
4.71
MLOGP
4.16
XLogP3
4.71
Consensus LogP
4.53
Log S (ESOL)
-4.39
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.36
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
No
Log Kp (skin permeation)
-1.32

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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