methane;2-methyl-3-silylprop-2-enoic acid

C6H16O2Si — CID 173490193

IUPACmethane;2-methyl-3-silylprop-2-enoic acid
SMILESC.C.CC(=C[SiH3])C(=O)O
InChIInChI=1S/C4H8O2Si.2CH4/c1-3(2-7)4(5)6;;/h2H,1,7H3,(H,5,6);2*1H4
InChIKeyFLENHIXKNAPYJI-UHFFFAOYSA-N
MW148.28 g/mol
LogP0.61
Rot. Bonds1

About methane;2-methyl-3-silylprop-2-enoic acid

methane;2-methyl-3-silylprop-2-enoic acid (PubChem CID 173490193) has the molecular formula C6H16O2Si and a molecular weight of 148.28 g/mol. Its IUPAC name is methane;2-methyl-3-silylprop-2-enoic acid.

Molecular Properties

Compound Namemethane;2-methyl-3-silylprop-2-enoic acid
PubChem CID173490193
Molecular FormulaC6H16O2Si
Molecular Weight148.28 g/mol
Exact Mass148.09
IUPAC Namemethane;2-methyl-3-silylprop-2-enoic acid
SMILESC.C.CC(=C[SiH3])C(=O)O
InChIInChI=1S/C4H8O2Si.2CH4/c1-3(2-7)4(5)6;;/h2H,1,7H3,(H,5,6);2*1H4
InChIKeyFLENHIXKNAPYJI-UHFFFAOYSA-N
XLogP0.61
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.28
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

2-methylbut-2-enoic acid;yttrium
CID 76824008
(E)-2-methylbut-2-enoic acid;hydrochloride
CID 87583281
2-methylbut-2-enoic acid;silane
CID 173038853
acetic acid;(E)-2-methylbut-2-enoic acid
CID 88739712
(E)-2-methyl-3-silyloxyprop-2-enoic acid
CID 173096363
dimethylazanide;methane;(Z)-2-methylbut-2-enoic acid;yttrium
CID 158291307
(2E)-2,5-dimethylhexa-2,4-dienoic acid
CID 18632121
methane;2-methyl-6-silylhex-2-enoic acid
CID 173490194
3-(2-carboxyprop-1-enylsulfanyl)-2-methylprop-2-enoic acid
CID 54108526
bis((E)-2-methylbut-2-enedioic acid);zirconium
CID 146019810
N,N-dimethylmethanamine;(E)-2-methylbut-2-enoic acid
CID 173038911
3-dimethylarsanyl-2-methylprop-2-enoic acid
CID 87783887

Frequently Asked Questions

What is the IUPAC name of methane;2-methyl-3-silylprop-2-enoic acid?
The IUPAC name of methane;2-methyl-3-silylprop-2-enoic acid (CID 173490193) is methane;2-methyl-3-silylprop-2-enoic acid.
What is the SMILES notation for methane;2-methyl-3-silylprop-2-enoic acid?
The canonical SMILES for methane;2-methyl-3-silylprop-2-enoic acid is C.C.CC(=C[SiH3])C(=O)O.
What is the InChIKey of methane;2-methyl-3-silylprop-2-enoic acid?
The InChIKey is FLENHIXKNAPYJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2Si.2CH4/c1-3(2-7)4(5)6;;/h2H,1,7H3,(H,5,6);2*1H4.
What are the key properties of methane;2-methyl-3-silylprop-2-enoic acid?
methane;2-methyl-3-silylprop-2-enoic acid has a molecular weight of 148.28 g/mol, XLogP of 0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methyl-3-silylprop-2-enoic acid is sourced from PubChem (CID 173490193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).