CID 87143851

C14H22O8Si2 — CID 87143851

IUPAC—
SMILESCC(=O)OC(OC(C)=O)[Si]CCCC[Si]C(OC(C)=O)OC(C)=O
InChIInChI=1S/C14H22O8Si2/c1-9(15)19-13(20-10(2)16)23-7-5-6-8-24-14(21-11(3)17)22-12(4)18/h13-14H,5-8H2,1-4H3
InChIKeyGKGJUTLBSQHLRJ-UHFFFAOYSA-N
MW374.49 g/mol
LogP0.83
Rot. Bonds11

About CID 87143851

CID 87143851 (PubChem CID 87143851) has the molecular formula C14H22O8Si2 and a molecular weight of 374.49 g/mol.

Molecular Properties

Compound NameCID 87143851
PubChem CID87143851
Molecular FormulaC14H22O8Si2
Molecular Weight374.49 g/mol
Exact Mass374.09
IUPAC Name—
SMILESCC(=O)OC(OC(C)=O)[Si]CCCC[Si]C(OC(C)=O)OC(C)=O
InChIInChI=1S/C14H22O8Si2/c1-9(15)19-13(20-10(2)16)23-7-5-6-8-24-14(21-11(3)17)22-12(4)18/h13-14H,5-8H2,1-4H3
InChIKeyGKGJUTLBSQHLRJ-UHFFFAOYSA-N
XLogP0.83
TPSA105.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze CID 87143851 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 87143851?
The IUPAC name of CID 87143851 (CID 87143851) is not available.
What is the SMILES notation for CID 87143851?
The canonical SMILES for CID 87143851 is CC(=O)OC(OC(C)=O)[Si]CCCC[Si]C(OC(C)=O)OC(C)=O.
What is the InChIKey of CID 87143851?
The InChIKey is GKGJUTLBSQHLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O8Si2/c1-9(15)19-13(20-10(2)16)23-7-5-6-8-24-14(21-11(3)17)22-12(4)18/h13-14H,5-8H2,1-4H3.
What are the key properties of CID 87143851?
CID 87143851 has a molecular weight of 374.49 g/mol, XLogP of 0.83, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87143851 is sourced from PubChem (CID 87143851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).