2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate

C19H34O6Si — CID 160722442

IUPAC2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O.C=C(C)C(=O)OC(C)C.C=C(C)C(=O)OC[Si](C)(C)C
InChIInChI=1S/C8H16O2Si.C7H12O2.C4H6O2/c1-7(2)8(9)10-6-11(3,4)5;1-5(2)7(8)9-6(3)4;1-3(2)4(5)6/h1,6H2,2-5H3;6H,1H2,2-4H3;1H2,2H3,(H,5,6)
InChIKeyRTGUOZLHDZCSRN-UHFFFAOYSA-N
MW386.56 g/mol
LogP4.14
Rot. Bonds6

About 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate

2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate (PubChem CID 160722442) has the molecular formula C19H34O6Si and a molecular weight of 386.56 g/mol. Its IUPAC name is 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
PubChem CID160722442
Molecular FormulaC19H34O6Si
Molecular Weight386.56 g/mol
Exact Mass386.21
IUPAC Name2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O.C=C(C)C(=O)OC(C)C.C=C(C)C(=O)OC[Si](C)(C)C
InChIInChI=1S/C8H16O2Si.C7H12O2.C4H6O2/c1-7(2)8(9)10-6-11(3,4)5;1-5(2)7(8)9-6(3)4;1-3(2)4(5)6/h1,6H2,2-5H3;6H,1H2,2-4H3;1H2,2H3,(H,5,6)
InChIKeyRTGUOZLHDZCSRN-UHFFFAOYSA-N
XLogP4.14
TPSA89.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.56
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

propan-2-yl 2-methylprop-2-enoate
CID 146421311
benzene;propan-2-yl 2-methylprop-2-enoate
CID 174524984
1-aminoethyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid
CID 174390329
1-O-[2-(2-methylprop-2-enoyloxy)ethyl] 2-O-propan-2-yl oxalate
CID 166723292
2-hydroxypropyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid
CID 87196210
butyl 2-methylprop-2-enoate;propan-2-yl 2-methylprop-2-enoate
CID 20503506
[dicarboxy(2-methylprop-2-enoyloxymethyl)silyl]formic acid
CID 163406071
trimethylsilylmethyl 2-fluoroprop-2-enoate
CID 71339155
trichlorosilylmethyl 2-methylprop-2-enoate
CID 22457275
2-phenylpropan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
CID 86753510
(1-hydroxy-2-trimethylsilylethyl) 2-methylprop-2-enoate
CID 54055275
2-[1,3-bis(2-methylprop-2-enoyloxy)propan-2-yloxycarbonyl]prop-2-enoic acid
CID 54328343

Frequently Asked Questions

What is the IUPAC name of 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate?
The IUPAC name of 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate (CID 160722442) is 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate is C=C(C)C(=O)O.C=C(C)C(=O)OC(C)C.C=C(C)C(=O)OC[Si](C)(C)C.
What is the InChIKey of 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate?
The InChIKey is RTGUOZLHDZCSRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2Si.C7H12O2.C4H6O2/c1-7(2)8(9)10-6-11(3,4)5;1-5(2)7(8)9-6(3)4;1-3(2)4(5)6/h1,6H2,2-5H3;6H,1H2,2-4H3;1H2,2H3,(H,5,6).
What are the key properties of 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate?
2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate has a molecular weight of 386.56 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylprop-2-enoic acid;propan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate is sourced from PubChem (CID 160722442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).