CID 57034707

C20H28ClF2Si — CID 57034707

IUPAC—
SMILESFCCC[Si]1CCC(C2CCC(c3ccc(Cl)c(F)c3)CC2)CC1
InChIInChI=1S/C20H28ClF2Si/c21-19-7-6-18(14-20(19)23)16-4-2-15(3-5-16)17-8-12-24(13-9-17)11-1-10-22/h6-7,14-17H,1-5,8-13H2
InChIKeyDYEIXOXOJZNUQH-UHFFFAOYSA-N
MW369.98 g/mol
LogP7.02
Rot. Bonds5

About CID 57034707

CID 57034707 (PubChem CID 57034707) has the molecular formula C20H28ClF2Si and a molecular weight of 369.98 g/mol.

Molecular Properties

Compound NameCID 57034707
PubChem CID57034707
Molecular FormulaC20H28ClF2Si
Molecular Weight369.98 g/mol
Exact Mass369.16
IUPAC Name—
SMILESFCCC[Si]1CCC(C2CCC(c3ccc(Cl)c(F)c3)CC2)CC1
InChIInChI=1S/C20H28ClF2Si/c21-19-7-6-18(14-20(19)23)16-4-2-15(3-5-16)17-8-12-24(13-9-17)11-1-10-22/h6-7,14-17H,1-5,8-13H2
InChIKeyDYEIXOXOJZNUQH-UHFFFAOYSA-N
XLogP7.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.98
LogP ≤ 57.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 57034707?
The IUPAC name of CID 57034707 (CID 57034707) is not available.
What is the SMILES notation for CID 57034707?
The canonical SMILES for CID 57034707 is FCCC[Si]1CCC(C2CCC(c3ccc(Cl)c(F)c3)CC2)CC1.
What is the InChIKey of CID 57034707?
The InChIKey is DYEIXOXOJZNUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28ClF2Si/c21-19-7-6-18(14-20(19)23)16-4-2-15(3-5-16)17-8-12-24(13-9-17)11-1-10-22/h6-7,14-17H,1-5,8-13H2.
What are the key properties of CID 57034707?
CID 57034707 has a molecular weight of 369.98 g/mol, XLogP of 7.02, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57034707 is sourced from PubChem (CID 57034707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).