CID 154612724

C7H14O3Si — CID 154612724

IUPAC—
SMILESCO[Si]CCOC(=O)C(C)C
InChIInChI=1S/C7H14O3Si/c1-6(2)7(8)10-4-5-11-9-3/h6H,4-5H2,1-3H3
InChIKeyNHGAAJUKYSGYAB-UHFFFAOYSA-N
MW174.27 g/mol
LogP0.87
Rot. Bonds5

About CID 154612724

CID 154612724 (PubChem CID 154612724) has the molecular formula C7H14O3Si and a molecular weight of 174.27 g/mol.

Molecular Properties

Compound NameCID 154612724
PubChem CID154612724
Molecular FormulaC7H14O3Si
Molecular Weight174.27 g/mol
Exact Mass174.07
IUPAC Name—
SMILESCO[Si]CCOC(=O)C(C)C
InChIInChI=1S/C7H14O3Si/c1-6(2)7(8)10-4-5-11-9-3/h6H,4-5H2,1-3H3
InChIKeyNHGAAJUKYSGYAB-UHFFFAOYSA-N
XLogP0.87
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.27
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-methoxyhexyl 2-methylpropanoate
CID 135199835
2-trimethoxysilylethyl 2-methylpropanoate
CID 59172701
2-(2-iodopropanoyloxy)ethyl 2-methylpropanoate
CID 166970068
2,2-dimethoxyethyl 2-methylpropanoate
CID 86008683
3-aminopropyl 2-methylpropanoate
CID 59078098
tris[2-(2-methylpropanoyloxy)ethyl]azanium
CID 154048574
butyl 2-methylpropanoate;2-methylpropane
CID 157176975
6-trihydroxysilylhexyl 2-methylpropanoate
CID 102303066
3-(diethylamino)propyl 2-methylpropanoate
CID 58333619
16-hydroxyhexadecyl 2-methylpropanoate
CID 134918438
8-aminooctyl 2-methylpropanoate
CID 88886116
3-oxopentyl 2-methylpropanoate
CID 58600127

Frequently Asked Questions

What is the IUPAC name of CID 154612724?
The IUPAC name of CID 154612724 (CID 154612724) is not available.
What is the SMILES notation for CID 154612724?
The canonical SMILES for CID 154612724 is CO[Si]CCOC(=O)C(C)C.
What is the InChIKey of CID 154612724?
The InChIKey is NHGAAJUKYSGYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3Si/c1-6(2)7(8)10-4-5-11-9-3/h6H,4-5H2,1-3H3.
What are the key properties of CID 154612724?
CID 154612724 has a molecular weight of 174.27 g/mol, XLogP of 0.87, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154612724 is sourced from PubChem (CID 154612724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).