tris(prop-2-enyl)silylformic acid

C10H16O2Si — CID 87199222

IUPACtris(prop-2-enyl)silylformic acid
SMILESC=CC[Si](CC=C)(CC=C)C(=O)O
InChIInChI=1S/C10H16O2Si/c1-4-7-13(8-5-2,9-6-3)10(11)12/h4-6H,1-3,7-9H2,(H,11,12)
InChIKeyALZQWBSAYSQCDK-UHFFFAOYSA-N
MW196.32 g/mol
LogP3.25
Rot. Bonds7

About tris(prop-2-enyl)silylformic acid

tris(prop-2-enyl)silylformic acid (PubChem CID 87199222) has the molecular formula C10H16O2Si and a molecular weight of 196.32 g/mol. Its IUPAC name is tris(prop-2-enyl)silylformic acid.

Molecular Properties

Compound Nametris(prop-2-enyl)silylformic acid
PubChem CID87199222
Molecular FormulaC10H16O2Si
Molecular Weight196.32 g/mol
Exact Mass196.09
IUPAC Nametris(prop-2-enyl)silylformic acid
SMILESC=CC[Si](CC=C)(CC=C)C(=O)O
InChIInChI=1S/C10H16O2Si/c1-4-7-13(8-5-2,9-6-3)10(11)12/h4-6H,1-3,7-9H2,(H,11,12)
InChIKeyALZQWBSAYSQCDK-UHFFFAOYSA-N
XLogP3.25
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[dicarboxy(prop-2-enyl)silyl]formic acid
CID 142722982
2-tris(prop-2-enyl)silylacetamide
CID 87577140
but-3-ene-1,1,1-tricarboxylic acid
CID 59237686
[acetyloxy-bis(prop-2-enyl)silyl] acetate
CID 18366415
tris(prop-2-enyl)silylformaldehyde
CID 87906925
acetic acid;but-1-ene
CID 88520349
[dimethyl(prop-2-enyl)silyl]-phenylmethanone
CID 135057035
carbonic acid;prop-2-enylcyclopropane
CID 67833665
(Z)-4-[dimethyl(prop-2-enyl)silyl]but-3-en-2-one
CID 10964920
2-(4-prop-2-enylcyclohexyl)acetic acid
CID 67843737
(benzoyloxy-methyl-prop-2-enylsilyl) benzoate
CID 54168383
(E)-2,3-bis(prop-2-enyl)but-2-enedioic acid
CID 87162043

Frequently Asked Questions

What is the IUPAC name of tris(prop-2-enyl)silylformic acid?
The IUPAC name of tris(prop-2-enyl)silylformic acid (CID 87199222) is tris(prop-2-enyl)silylformic acid.
What is the SMILES notation for tris(prop-2-enyl)silylformic acid?
The canonical SMILES for tris(prop-2-enyl)silylformic acid is C=CC[Si](CC=C)(CC=C)C(=O)O.
What is the InChIKey of tris(prop-2-enyl)silylformic acid?
The InChIKey is ALZQWBSAYSQCDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2Si/c1-4-7-13(8-5-2,9-6-3)10(11)12/h4-6H,1-3,7-9H2,(H,11,12).
What are the key properties of tris(prop-2-enyl)silylformic acid?
tris(prop-2-enyl)silylformic acid has a molecular weight of 196.32 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(prop-2-enyl)silylformic acid is sourced from PubChem (CID 87199222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).