trimethylsilylmethyl 2-fluoroprop-2-enoate

C7H13FO2Si — CID 71339155

IUPACtrimethylsilylmethyl 2-fluoroprop-2-enoate
SMILESC=C(F)C(=O)OC[Si](C)(C)C
InChIInChI=1S/C7H13FO2Si/c1-6(8)7(9)10-5-11(2,3)4/h1,5H2,2-4H3
InChIKeyYCYFTXZPQBUCFB-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.89
Rot. Bonds3

About trimethylsilylmethyl 2-fluoroprop-2-enoate

trimethylsilylmethyl 2-fluoroprop-2-enoate (PubChem CID 71339155) has the molecular formula C7H13FO2Si and a molecular weight of 176.26 g/mol. Its IUPAC name is trimethylsilylmethyl 2-fluoroprop-2-enoate.

Molecular Properties

Compound Nametrimethylsilylmethyl 2-fluoroprop-2-enoate
PubChem CID71339155
Molecular FormulaC7H13FO2Si
Molecular Weight176.26 g/mol
Exact Mass176.07
IUPAC Nametrimethylsilylmethyl 2-fluoroprop-2-enoate
SMILESC=C(F)C(=O)OC[Si](C)(C)C
InChIInChI=1S/C7H13FO2Si/c1-6(8)7(9)10-5-11(2,3)4/h1,5H2,2-4H3
InChIKeyYCYFTXZPQBUCFB-UHFFFAOYSA-N
XLogP1.89
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.89
H-Bond Donors ≤ 50
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

CID 175995571
CID 175995571
3-trimethylsilylprop-2-ynyl 2-fluoroprop-2-enoate
CID 149346214
2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
CID 160722442
trimethylsilylmethyl 2-hydroxyacetate
CID 58637933
3-trichlorosilylpropyl 2-fluoroprop-2-enoate
CID 139621788
2-(2-fluoroprop-2-enoyloxy)butyl 2-fluoroprop-2-enoate
CID 89060077
2-phenylpropan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
CID 86753510
tert-butyl 2-methylprop-2-enoate;trimethylsilylmethyl prop-2-enoate
CID 86753515
trichlorosilylmethyl 2-methylprop-2-enoate
CID 22457275
ethyl 3-deuterio-2-fluoroprop-2-enoate
CID 88506184
3-ethylpentan-3-yl 2-fluoroprop-2-enoate
CID 122693494
iodo 2-fluoroprop-2-enoate
CID 166890088

Frequently Asked Questions

What is the IUPAC name of trimethylsilylmethyl 2-fluoroprop-2-enoate?
The IUPAC name of trimethylsilylmethyl 2-fluoroprop-2-enoate (CID 71339155) is trimethylsilylmethyl 2-fluoroprop-2-enoate.
What is the SMILES notation for trimethylsilylmethyl 2-fluoroprop-2-enoate?
The canonical SMILES for trimethylsilylmethyl 2-fluoroprop-2-enoate is C=C(F)C(=O)OC[Si](C)(C)C.
What is the InChIKey of trimethylsilylmethyl 2-fluoroprop-2-enoate?
The InChIKey is YCYFTXZPQBUCFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13FO2Si/c1-6(8)7(9)10-5-11(2,3)4/h1,5H2,2-4H3.
What are the key properties of trimethylsilylmethyl 2-fluoroprop-2-enoate?
trimethylsilylmethyl 2-fluoroprop-2-enoate has a molecular weight of 176.26 g/mol, XLogP of 1.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilylmethyl 2-fluoroprop-2-enoate is sourced from PubChem (CID 71339155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).