CID 156681384

C14H24F2O2Si — CID 156681384

IUPAC
SMILESC=CC(=O)OCCCCCCCCCC[Si]C(F)F
InChIInChI=1S/C14H24F2O2Si/c1-2-13(17)18-11-9-7-5-3-4-6-8-10-12-19-14(15)16/h2,14H,1,3-12H2
InChIKeyVAEXOXMIJVSPGV-UHFFFAOYSA-N
MW290.43 g/mol
LogP4.18
Rot. Bonds13

About CID 156681384

CID 156681384 (PubChem CID 156681384) has the molecular formula C14H24F2O2Si and a molecular weight of 290.43 g/mol.

Molecular Properties

Compound NameCID 156681384
PubChem CID156681384
Molecular FormulaC14H24F2O2Si
Molecular Weight290.43 g/mol
Exact Mass290.15
IUPAC Name
SMILESC=CC(=O)OCCCCCCCCCC[Si]C(F)F
InChIInChI=1S/C14H24F2O2Si/c1-2-13(17)18-11-9-7-5-3-4-6-8-10-12-19-14(15)16/h2,14H,1,3-12H2
InChIKeyVAEXOXMIJVSPGV-UHFFFAOYSA-N
XLogP4.18
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 156681384?
The IUPAC name of CID 156681384 (CID 156681384) is not available.
What is the SMILES notation for CID 156681384?
The canonical SMILES for CID 156681384 is C=CC(=O)OCCCCCCCCCC[Si]C(F)F.
What is the InChIKey of CID 156681384?
The InChIKey is VAEXOXMIJVSPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F2O2Si/c1-2-13(17)18-11-9-7-5-3-4-6-8-10-12-19-14(15)16/h2,14H,1,3-12H2.
What are the key properties of CID 156681384?
CID 156681384 has a molecular weight of 290.43 g/mol, XLogP of 4.18, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 156681384 is sourced from PubChem (CID 156681384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).