CID 23094248

C8H15O3Si — CID 23094248

IUPAC—
SMILESC=C(C)C(=O)OCCC[Si](C)O
InChIInChI=1S/C8H15O3Si/c1-7(2)8(9)11-5-4-6-12(3)10/h10H,1,4-6H2,2-3H3
InChIKeyBXQRQEQEUXWJLN-UHFFFAOYSA-N
MW187.29 g/mol
LogP1.11
Rot. Bonds5

About CID 23094248

CID 23094248 (PubChem CID 23094248) has the molecular formula C8H15O3Si and a molecular weight of 187.29 g/mol.

Molecular Properties

Compound NameCID 23094248
PubChem CID23094248
Molecular FormulaC8H15O3Si
Molecular Weight187.29 g/mol
Exact Mass187.08
IUPAC Name—
SMILESC=C(C)C(=O)OCCC[Si](C)O
InChIInChI=1S/C8H15O3Si/c1-7(2)8(9)11-5-4-6-12(3)10/h10H,1,4-6H2,2-3H3
InChIKeyBXQRQEQEUXWJLN-UHFFFAOYSA-N
XLogP1.11
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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Related Compounds

4-[4-[4-(2-methylprop-2-enoyloxy)butoxy]butoxy]butyl 2-methylprop-2-enoate
CID 101360150
bis[4-(2-methylprop-2-enoyloxy)butyl] oxalate
CID 118147382
3-[2-[3-(2-methylprop-2-enoyloxy)propoxy]ethoxy]propyl 2-methylprop-2-enoate
CID 87490108
ethene;4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate;6-(2-methylprop-2-enoyloxy)hexyl 2-methylprop-2-enoate
CID 88685309
bis(ethane-1,2-diol);4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate
CID 88656789
4-acetyloxybutyl 2-methylprop-2-enoate
CID 21403527
3-(trimethyl-λ4-sulfanyl)propyl 2-methylprop-2-enoate
CID 126489334
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
3-sulfanylpropyl 2-methylprop-2-enoate
CID 10034892
butyl 2-methylprop-2-enoate;ethene
CID 158758814
butyl 2-methylprop-2-enoate;methane
CID 159646333
3-(2-methylprop-2-enoyloxy)propyl 2-methylprop-2-enoate;phosphoric acid
CID 87531056

Frequently Asked Questions

What is the IUPAC name of CID 23094248?
The IUPAC name of CID 23094248 (CID 23094248) is not available.
What is the SMILES notation for CID 23094248?
The canonical SMILES for CID 23094248 is C=C(C)C(=O)OCCC[Si](C)O.
What is the InChIKey of CID 23094248?
The InChIKey is BXQRQEQEUXWJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15O3Si/c1-7(2)8(9)11-5-4-6-12(3)10/h10H,1,4-6H2,2-3H3.
What are the key properties of CID 23094248?
CID 23094248 has a molecular weight of 187.29 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23094248 is sourced from PubChem (CID 23094248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).