prop-2-enoic acid;silylmethanol

C4H10O3Si — CID 175499184

IUPACprop-2-enoic acid;silylmethanol
SMILESC=CC(=O)O.OC[SiH3]
InChIInChI=1S/C3H4O2.CH6OSi/c1-2-3(4)5;2-1-3/h2H,1H2,(H,4,5);2H,1H2,3H3
InChIKeyCJFVQUIGBCEFFX-UHFFFAOYSA-N
MW134.21 g/mol
LogP-1.44
Rot. Bonds1

About prop-2-enoic acid;silylmethanol

prop-2-enoic acid;silylmethanol (PubChem CID 175499184) has the molecular formula C4H10O3Si and a molecular weight of 134.21 g/mol. Its IUPAC name is prop-2-enoic acid;silylmethanol.

Molecular Properties

Compound Nameprop-2-enoic acid;silylmethanol
PubChem CID175499184
Molecular FormulaC4H10O3Si
Molecular Weight134.21 g/mol
Exact Mass134.04
IUPAC Nameprop-2-enoic acid;silylmethanol
SMILESC=CC(=O)O.OC[SiH3]
InChIInChI=1S/C3H4O2.CH6OSi/c1-2-3(4)5;2-1-3/h2H,1H2,(H,4,5);2H,1H2,3H3
InChIKeyCJFVQUIGBCEFFX-UHFFFAOYSA-N
XLogP-1.44
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.21
LogP ≤ 5-1.44
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'}

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Related Compounds

dodecakis(ethane-1,2-diol);tridecakis(prop-2-enoic acid)
CID 173073218
ethane-1,2-diol;tetrakis(prop-2-enoic acid)
CID 157215005
ethanol;prop-2-enoic acid
CID 159350313
ethenylsilane;prop-2-enoic acid
CID 159736042
prop-2-enoic acid;hydrochloride
CID 22354205
CID 87061462
CID 87061462
iron(2+);prop-2-enoic acid
CID 10290804
bis(prop-2-enoic acid);hydrochloride
CID 88811054
cerium;bis(prop-2-enoic acid)
CID 169316659
Acrylic acid potassium salt
CID 87124626
lutetium;tris(prop-2-enoic acid)
CID 168865611
prop-2-enoic acid;hexahydrate
CID 172682107

Frequently Asked Questions

What is the IUPAC name of prop-2-enoic acid;silylmethanol?
The IUPAC name of prop-2-enoic acid;silylmethanol (CID 175499184) is prop-2-enoic acid;silylmethanol.
What is the SMILES notation for prop-2-enoic acid;silylmethanol?
The canonical SMILES for prop-2-enoic acid;silylmethanol is C=CC(=O)O.OC[SiH3].
What is the InChIKey of prop-2-enoic acid;silylmethanol?
The InChIKey is CJFVQUIGBCEFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4O2.CH6OSi/c1-2-3(4)5;2-1-3/h2H,1H2,(H,4,5);2H,1H2,3H3.
What are the key properties of prop-2-enoic acid;silylmethanol?
prop-2-enoic acid;silylmethanol has a molecular weight of 134.21 g/mol, XLogP of -1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enoic acid;silylmethanol is sourced from PubChem (CID 175499184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).