3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate

C14H24O4Si — CID 175549235

IUPAC3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[SiH2]CCCOC(=O)C(=C)C
InChIInChI=1S/C14H24O4Si/c1-11(2)13(15)17-7-5-9-19-10-6-8-18-14(16)12(3)4/h1,3,5-10,19H2,2,4H3
InChIKeyVXZPBMLWPLTHHI-UHFFFAOYSA-N
MW284.43 g/mol
LogP2.01
Rot. Bonds10

About 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate

3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate (PubChem CID 175549235) has the molecular formula C14H24O4Si and a molecular weight of 284.43 g/mol. Its IUPAC name is 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate
PubChem CID175549235
Molecular FormulaC14H24O4Si
Molecular Weight284.43 g/mol
Exact Mass284.14
IUPAC Name3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[SiH2]CCCOC(=O)C(=C)C
InChIInChI=1S/C14H24O4Si/c1-11(2)13(15)17-7-5-9-19-10-6-8-18-14(16)12(3)4/h1,3,5-10,19H2,2,4H3
InChIKeyVXZPBMLWPLTHHI-UHFFFAOYSA-N
XLogP2.01
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.43
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate (CID 175549235) is 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[SiH2]CCCOC(=O)C(=C)C.
What is the InChIKey of 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate?
The InChIKey is VXZPBMLWPLTHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O4Si/c1-11(2)13(15)17-7-5-9-19-10-6-8-18-14(16)12(3)4/h1,3,5-10,19H2,2,4H3.
What are the key properties of 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate?
3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate has a molecular weight of 284.43 g/mol, XLogP of 2.01, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methylprop-2-enoyloxy)propylsilyl]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 175549235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).