dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane

C10H18F6O2Si — CID 19900040

IUPACdimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane
SMILESCO[Si](OC)(C(C)CC(F)(F)F)C(C)CC(F)(F)F
InChIInChI=1S/C10H18F6O2Si/c1-7(5-9(11,12)13)19(17-3,18-4)8(2)6-10(14,15)16/h7-8H,5-6H2,1-4H3
InChIKeyYDPCJZOWLXZXKI-UHFFFAOYSA-N
MW312.33 g/mol
LogP4.41
Rot. Bonds6

About dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane

dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane (PubChem CID 19900040) has the molecular formula C10H18F6O2Si and a molecular weight of 312.33 g/mol. Its IUPAC name is dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane.

Molecular Properties

Compound Namedimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane
PubChem CID19900040
Molecular FormulaC10H18F6O2Si
Molecular Weight312.33 g/mol
Exact Mass312.10
IUPAC Namedimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane
SMILESCO[Si](OC)(C(C)CC(F)(F)F)C(C)CC(F)(F)F
InChIInChI=1S/C10H18F6O2Si/c1-7(5-9(11,12)13)19(17-3,18-4)8(2)6-10(14,15)16/h7-8H,5-6H2,1-4H3
InChIKeyYDPCJZOWLXZXKI-UHFFFAOYSA-N
XLogP4.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane?
The IUPAC name of dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane (CID 19900040) is dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane.
What is the SMILES notation for dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane?
The canonical SMILES for dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane is CO[Si](OC)(C(C)CC(F)(F)F)C(C)CC(F)(F)F.
What is the InChIKey of dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane?
The InChIKey is YDPCJZOWLXZXKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F6O2Si/c1-7(5-9(11,12)13)19(17-3,18-4)8(2)6-10(14,15)16/h7-8H,5-6H2,1-4H3.
What are the key properties of dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane?
dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane has a molecular weight of 312.33 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-bis(4,4,4-trifluorobutan-2-yl)silane is sourced from PubChem (CID 19900040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).