CID 18787773

C6H12F3O3Si2 — CID 18787773

IUPAC—
SMILESC[Si](OC(=O)C(F)(F)F)O[Si](C)(C)C
InChIInChI=1S/C6H12F3O3Si2/c1-13(12-14(2,3)4)11-5(10)6(7,8)9/h1-4H3
InChIKeyYBJLSGMFXBUCNF-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.06
Rot. Bonds3

About CID 18787773

CID 18787773 (PubChem CID 18787773) has the molecular formula C6H12F3O3Si2 and a molecular weight of 245.32 g/mol.

Molecular Properties

Compound NameCID 18787773
PubChem CID18787773
Molecular FormulaC6H12F3O3Si2
Molecular Weight245.32 g/mol
Exact Mass245.03
IUPAC Name—
SMILESC[Si](OC(=O)C(F)(F)F)O[Si](C)(C)C
InChIInChI=1S/C6H12F3O3Si2/c1-13(12-14(2,3)4)11-5(10)6(7,8)9/h1-4H3
InChIKeyYBJLSGMFXBUCNF-UHFFFAOYSA-N
XLogP2.06
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 CID 18787773?
The IUPAC name of CID 18787773 (CID 18787773) is not available.
What is the SMILES notation for CID 18787773?
The canonical SMILES for CID 18787773 is C[Si](OC(=O)C(F)(F)F)O[Si](C)(C)C.
What is the InChIKey of CID 18787773?
The InChIKey is YBJLSGMFXBUCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12F3O3Si2/c1-13(12-14(2,3)4)11-5(10)6(7,8)9/h1-4H3.
What are the key properties of CID 18787773?
CID 18787773 has a molecular weight of 245.32 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18787773 is sourced from PubChem (CID 18787773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).