[3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate

C16H24O7Si — CID 173124808

IUPAC[3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(CC[SiH2]OC)(OC(=O)C(=C)C)OC(=O)C(=C)C
InChIInChI=1S/C16H24O7Si/c1-10(2)13(17)21-16(8-9-24-20-7,22-14(18)11(3)4)23-15(19)12(5)6/h1,3,5,8-9,24H2,2,4,6-7H3
InChIKeyWFMLVJWDOGTAME-UHFFFAOYSA-N
MW356.45 g/mol
LogP1.54
Rot. Bonds10

About [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate

[3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate (PubChem CID 173124808) has the molecular formula C16H24O7Si and a molecular weight of 356.45 g/mol. Its IUPAC name is [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate
PubChem CID173124808
Molecular FormulaC16H24O7Si
Molecular Weight356.45 g/mol
Exact Mass356.13
IUPAC Name[3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(CC[SiH2]OC)(OC(=O)C(=C)C)OC(=O)C(=C)C
InChIInChI=1S/C16H24O7Si/c1-10(2)13(17)21-16(8-9-24-20-7,22-14(18)11(3)4)23-15(19)12(5)6/h1,3,5,8-9,24H2,2,4,6-7H3
InChIKeyWFMLVJWDOGTAME-UHFFFAOYSA-N
XLogP1.54
TPSA88.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

[2-hydroxy-1,1-bis(2-methylprop-2-enoyloxy)ethyl] 2-methylprop-2-enoate
CID 139619196
[4-hydroxy-1,1-bis(2-methylprop-2-enoyloxy)butyl] 2-methylprop-2-enoate
CID 87402298
[4-hydroxy-3,3-bis(hydroxymethyl)-1,1-bis(2-methylprop-2-enoyloxy)butyl] 2-methylprop-2-enoate
CID 172736329
2-[dimethyl(3,3,3-trifluoropropylsilyloxy)silyl]propan-2-yl 2-methylprop-2-enoate
CID 123513467
1,1-dihydroxyethyl 2-methylprop-2-enoate
CID 54314895
[2-methyl-3,3-bis(2-methylprop-2-enoyloxy)butan-2-yl] 2-methylprop-2-enoate
CID 142750800
1-methoxysilylpropan-2-yl 2-methylprop-2-enoate
CID 154050270
2-(2-methylprop-2-enoyloxy)pentan-2-yl 2-methylprop-2-enoate
CID 141014982
2,5,5-trimethylhexan-2-yl 2-methylprop-2-enoate
CID 88557517
1,1-bis(2-methylprop-2-enoyloxy)butyl 2-methyl-3-oxopropanoate
CID 90714140
methyl 2-methylprop-2-enoate;propan-2-one
CID 18939878
methyl 2-methylprop-2-enoate;nickel
CID 88732958

Frequently Asked Questions

What is the IUPAC name of [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate?
The IUPAC name of [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate (CID 173124808) is [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate.
What is the SMILES notation for [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate?
The canonical SMILES for [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate is C=C(C)C(=O)OC(CC[SiH2]OC)(OC(=O)C(=C)C)OC(=O)C(=C)C.
What is the InChIKey of [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate?
The InChIKey is WFMLVJWDOGTAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O7Si/c1-10(2)13(17)21-16(8-9-24-20-7,22-14(18)11(3)4)23-15(19)12(5)6/h1,3,5,8-9,24H2,2,4,6-7H3.
What are the key properties of [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate?
[3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate has a molecular weight of 356.45 g/mol, XLogP of 1.54, 10 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxysilyl-1,1-bis(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate is sourced from PubChem (CID 173124808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).