trimethylsilylmethylsilyl propanoate

C7H18O2Si2 — CID 173252612

IUPACtrimethylsilylmethylsilyl propanoate
SMILESCCC(=O)O[SiH2]C[Si](C)(C)C
InChIInChI=1S/C7H18O2Si2/c1-5-7(8)9-10-6-11(2,3)4/h5-6,10H2,1-4H3
InChIKeyPGTMGRJGLJJTGO-UHFFFAOYSA-N
MW190.39 g/mol
LogP1.32
Rot. Bonds4

About trimethylsilylmethylsilyl propanoate

trimethylsilylmethylsilyl propanoate (PubChem CID 173252612) has the molecular formula C7H18O2Si2 and a molecular weight of 190.39 g/mol. Its IUPAC name is trimethylsilylmethylsilyl propanoate.

Molecular Properties

Compound Nametrimethylsilylmethylsilyl propanoate
PubChem CID173252612
Molecular FormulaC7H18O2Si2
Molecular Weight190.39 g/mol
Exact Mass190.08
IUPAC Nametrimethylsilylmethylsilyl propanoate
SMILESCCC(=O)O[SiH2]C[Si](C)(C)C
InChIInChI=1S/C7H18O2Si2/c1-5-7(8)9-10-6-11(2,3)4/h5-6,10H2,1-4H3
InChIKeyPGTMGRJGLJJTGO-UHFFFAOYSA-N
XLogP1.32
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.39
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze trimethylsilylmethylsilyl propanoate with MolForge

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

Launch Full Analysis

Related Compounds

[dimethoxy(methyl)silyl] propanoate
CID 87595419
propanoyl (113C)propanoate
CID 91179573
silylmethyl propanoate
CID 152513576
[dibromo(propanoyloxy)silyl] propanoate
CID 139686973
tert-butyl propanoate;hydrobromide
CID 172778720
dipropanoyl butanedioate
CID 146216618
propanoyloxy-λ2-stannane
CID 173456890
methyl propanoate;dihydrochloride
CID 140968159
CID 59894625
CID 59894625
CID 87773794
CID 87773794
[hydroxy-[5-[hydroxy(propanoyloxy)amino]pentyl]amino] propanoate
CID 146230533
1,1-dihydroxypropyl propanoate
CID 140990994

Frequently Asked Questions

What is the IUPAC name of trimethylsilylmethylsilyl propanoate?
The IUPAC name of trimethylsilylmethylsilyl propanoate (CID 173252612) is trimethylsilylmethylsilyl propanoate.
What is the SMILES notation for trimethylsilylmethylsilyl propanoate?
The canonical SMILES for trimethylsilylmethylsilyl propanoate is CCC(=O)O[SiH2]C[Si](C)(C)C.
What is the InChIKey of trimethylsilylmethylsilyl propanoate?
The InChIKey is PGTMGRJGLJJTGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O2Si2/c1-5-7(8)9-10-6-11(2,3)4/h5-6,10H2,1-4H3.
What are the key properties of trimethylsilylmethylsilyl propanoate?
trimethylsilylmethylsilyl propanoate has a molecular weight of 190.39 g/mol, XLogP of 1.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilylmethylsilyl propanoate is sourced from PubChem (CID 173252612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).