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Molecule
ID:99796
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₂₅F₃O₂Si₃
Molecular Mass
318.5560096
Exact Mass
318.1114443
Charge
0
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
Canonic Smiles
FC(CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C)(F)F
Isomeric Smiles
[Si](O[Si](O[Si](C)(C)C)(CCC(F)(F)F)C)(C)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
4.5011
LogD (pH = 7.4)
4.5011
Log P
4.5011
Molar Refractivity
59.0913
Polarizability
28.709465
Polar Surface Area
18.46
Rotatable Bonds
7
Lipinski's Rule of Five
true
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Molecule Details
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Bioactivity
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Data Source
Commercial Catalog
Apollo Scientific
PC7820FJ
Academic Data
PubChem
2778751
Names and Identifiers
IUPAC name
2,2,4,6,6-pentamethyl-4-(3,3,3-trifluoropropyl)-3,5-dioxa-2,4,6-trisilaheptane
Synonyms
3-(3,3,3-Trifluoropropyl)heptamethyltrisiloxane 97%
IUPAC Traditional name
2,2,4,6,6-pentamethyl-4-(3,3,3-trifluoropropyl)-3,5-dioxa-2,4,6-trisilaheptane
Registration numbers
CAS Number
27703-88-4
MDL Number
MFCD00236727
PubChem CID
2778751
PubChem SID
162086044
Properties
Safety Information
Storage Warning
Corrosive
Source
Physical Property
Boiling Point
66-68°C/10mm
Source
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay