2-hydroxy-1-silylpropan-1-one

C3H8O2Si — CID 150934349

IUPAC2-hydroxy-1-silylpropan-1-one
SMILESCC(O)C(=O)[SiH3]
InChIInChI=1S/C3H8O2Si/c1-2(4)3(5)6/h2,4H,1,6H3
InChIKeyLGRXVPPCSQDLGU-UHFFFAOYSA-N
MW104.18 g/mol
LogP-1.74
Rot. Bonds1

About 2-hydroxy-1-silylpropan-1-one

2-hydroxy-1-silylpropan-1-one (PubChem CID 150934349) has the molecular formula C3H8O2Si and a molecular weight of 104.18 g/mol. Its IUPAC name is 2-hydroxy-1-silylpropan-1-one.

Molecular Properties

Compound Name2-hydroxy-1-silylpropan-1-one
PubChem CID150934349
Molecular FormulaC3H8O2Si
Molecular Weight104.18 g/mol
Exact Mass104.03
IUPAC Name2-hydroxy-1-silylpropan-1-one
SMILESCC(O)C(=O)[SiH3]
InChIInChI=1S/C3H8O2Si/c1-2(4)3(5)6/h2,4H,1,6H3
InChIKeyLGRXVPPCSQDLGU-UHFFFAOYSA-N
XLogP-1.74
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.18
LogP ≤ 5-1.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxypropanoic acid
CID 87075455
bis(2-hydroxypropanoic acid);titanium
CID 173417954
CID 131877347
CID 131877347
calcium hexakis(2-hydroxypropanoic acid)
CID 162368187
2-hydroxypropanoic acid;mercury
CID 88512020
CID 123133976
CID 123133976
tetrakis(2-hydroxypropanoic acid);manganese
CID 167442579
CID 11776805
CID 11776805
CID 129137181
CID 129137181
2-hydroxypropanoic acid;tetrahydrate
CID 141343914
pentaheptacontacalcium;(2-hydroxypropanoic acid)
CID 173046474
CID 59233637
CID 59233637

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-silylpropan-1-one?
The IUPAC name of 2-hydroxy-1-silylpropan-1-one (CID 150934349) is 2-hydroxy-1-silylpropan-1-one.
What is the SMILES notation for 2-hydroxy-1-silylpropan-1-one?
The canonical SMILES for 2-hydroxy-1-silylpropan-1-one is CC(O)C(=O)[SiH3].
What is the InChIKey of 2-hydroxy-1-silylpropan-1-one?
The InChIKey is LGRXVPPCSQDLGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O2Si/c1-2(4)3(5)6/h2,4H,1,6H3.
What are the key properties of 2-hydroxy-1-silylpropan-1-one?
2-hydroxy-1-silylpropan-1-one has a molecular weight of 104.18 g/mol, XLogP of -1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-silylpropan-1-one is sourced from PubChem (CID 150934349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).