3-[dipropoxy(propyl)silyl]propyl prop-2-enoate

C15H30O4Si — CID 21432072

IUPAC3-[dipropoxy(propyl)silyl]propyl prop-2-enoate
SMILESC=CC(=O)OCCC[Si](CCC)(OCCC)OCCC
InChIInChI=1S/C15H30O4Si/c1-5-10-18-20(13-7-3,19-11-6-2)14-9-12-17-15(16)8-4/h8H,4-7,9-14H2,1-3H3
InChIKeyVDAZWTKAOZBBNQ-UHFFFAOYSA-N
MW302.49 g/mol
LogP3.81
Rot. Bonds13

About 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate

3-[dipropoxy(propyl)silyl]propyl prop-2-enoate (PubChem CID 21432072) has the molecular formula C15H30O4Si and a molecular weight of 302.49 g/mol. Its IUPAC name is 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate.

Molecular Properties

Compound Name3-[dipropoxy(propyl)silyl]propyl prop-2-enoate
PubChem CID21432072
Molecular FormulaC15H30O4Si
Molecular Weight302.49 g/mol
Exact Mass302.19
IUPAC Name3-[dipropoxy(propyl)silyl]propyl prop-2-enoate
SMILESC=CC(=O)OCCC[Si](CCC)(OCCC)OCCC
InChIInChI=1S/C15H30O4Si/c1-5-10-18-20(13-7-3,19-11-6-2)14-9-12-17-15(16)8-4/h8H,4-7,9-14H2,1-3H3
InChIKeyVDAZWTKAOZBBNQ-UHFFFAOYSA-N
XLogP3.81
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.49
LogP ≤ 53.81
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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Related Compounds

3-[dimethoxy(propyl)silyl]propyl prop-2-enoate
CID 21432068
2-[diethoxy(propyl)silyl]ethyl prop-2-enoate
CID 87194631
2-[ethyl(dipropoxy)silyl]ethyl prop-2-enoate
CID 21432014
3-[3-prop-2-enoyloxypropyl(dipropyl)silyl]propyl prop-2-enoate
CID 87228396
13-[dimethoxy(propyl)silyl]tridecyl prop-2-enoate
CID 150352297
3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate
CID 172555939
3-[dibutoxy(methyl)silyl]propyl prop-2-enoate
CID 21432061
3-tripentoxysilylpropyl prop-2-enoate
CID 151204895
3-[butoxy(dimethyl)silyl]propyl prop-2-enoate
CID 142550479
pentyl prop-2-enoate;propyl prop-2-enoate
CID 175293000
3-[butoxy(diethyl)silyl]propyl prop-2-enoate
CID 152603215
3-[[bis[[dimethyl(3-prop-2-enoyloxypropyl)silyl]oxy]-propylsilyl]oxy-dimethylsilyl]propyl prop-2-enoate
CID 166010478

Frequently Asked Questions

What is the IUPAC name of 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate?
The IUPAC name of 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate (CID 21432072) is 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate.
What is the SMILES notation for 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate?
The canonical SMILES for 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate is C=CC(=O)OCCC[Si](CCC)(OCCC)OCCC.
What is the InChIKey of 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate?
The InChIKey is VDAZWTKAOZBBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O4Si/c1-5-10-18-20(13-7-3,19-11-6-2)14-9-12-17-15(16)8-4/h8H,4-7,9-14H2,1-3H3.
What are the key properties of 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate?
3-[dipropoxy(propyl)silyl]propyl prop-2-enoate has a molecular weight of 302.49 g/mol, XLogP of 3.81, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dipropoxy(propyl)silyl]propyl prop-2-enoate is sourced from PubChem (CID 21432072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).