prop-2-enoic acid;2-silylprop-2-enoic acid

C6H10O4Si — CID 160581916

IUPACprop-2-enoic acid;2-silylprop-2-enoic acid
SMILESC=C([SiH3])C(=O)O.C=CC(=O)O
InChIInChI=1S/C3H6O2Si.C3H4O2/c1-2(6)3(4)5;1-2-3(4)5/h1H2,6H3,(H,4,5);2H,1H2,(H,4,5)
InChIKeyRBWWACHCFKDGFM-UHFFFAOYSA-N
MW174.23 g/mol
LogP-0.79
Rot. Bonds2

About prop-2-enoic acid;2-silylprop-2-enoic acid

prop-2-enoic acid;2-silylprop-2-enoic acid (PubChem CID 160581916) has the molecular formula C6H10O4Si and a molecular weight of 174.23 g/mol. Its IUPAC name is prop-2-enoic acid;2-silylprop-2-enoic acid.

Molecular Properties

Compound Nameprop-2-enoic acid;2-silylprop-2-enoic acid
PubChem CID160581916
Molecular FormulaC6H10O4Si
Molecular Weight174.23 g/mol
Exact Mass174.03
IUPAC Nameprop-2-enoic acid;2-silylprop-2-enoic acid
SMILESC=C([SiH3])C(=O)O.C=CC(=O)O
InChIInChI=1S/C3H6O2Si.C3H4O2/c1-2(6)3(4)5;1-2-3(4)5/h1H2,6H3,(H,4,5);2H,1H2,(H,4,5)
InChIKeyRBWWACHCFKDGFM-UHFFFAOYSA-N
XLogP-0.79
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.23
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze prop-2-enoic acid;2-silylprop-2-enoic acid 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

2-hydroxyprop-2-enoic acid;bis(prop-2-enoic acid)
CID 87459377
tris(prop-2-enoic acid);silyloxysilane
CID 175696616
2-methylprop-2-enoic acid;prop-2-enoic acid;silylsilane
CID 173358641
ethenylsilane;prop-2-enoic acid
CID 159736042
prop-2-enoic acid;hydrochloride
CID 22354205
cerium;bis(prop-2-enoic acid)
CID 169316659
bis(prop-2-enoic acid);hydrochloride
CID 88811054
CID 87061462
CID 87061462
iron(2+);prop-2-enoic acid
CID 10290804
Acrylic acid potassium salt
CID 87124626
prop-2-enoic acid;hexahydrate
CID 172682107
azane;prop-2-enoic acid
CID 173158019

Frequently Asked Questions

What is the IUPAC name of prop-2-enoic acid;2-silylprop-2-enoic acid?
The IUPAC name of prop-2-enoic acid;2-silylprop-2-enoic acid (CID 160581916) is prop-2-enoic acid;2-silylprop-2-enoic acid.
What is the SMILES notation for prop-2-enoic acid;2-silylprop-2-enoic acid?
The canonical SMILES for prop-2-enoic acid;2-silylprop-2-enoic acid is C=C([SiH3])C(=O)O.C=CC(=O)O.
What is the InChIKey of prop-2-enoic acid;2-silylprop-2-enoic acid?
The InChIKey is RBWWACHCFKDGFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O2Si.C3H4O2/c1-2(6)3(4)5;1-2-3(4)5/h1H2,6H3,(H,4,5);2H,1H2,(H,4,5).
What are the key properties of prop-2-enoic acid;2-silylprop-2-enoic acid?
prop-2-enoic acid;2-silylprop-2-enoic acid has a molecular weight of 174.23 g/mol, XLogP of -0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enoic acid;2-silylprop-2-enoic acid is sourced from PubChem (CID 160581916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).