propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate

C10H20O3Si — CID 174982118

IUPACpropyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate
SMILESCCCOC(=O)C(C)=C[SiH2]OC(C)C
InChIInChI=1S/C10H20O3Si/c1-5-6-12-10(11)9(4)7-14-13-8(2)3/h7-8H,5-6,14H2,1-4H3
InChIKeyOXKUXIQUNMHBSW-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.35
Rot. Bonds6

About propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate

propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate (PubChem CID 174982118) has the molecular formula C10H20O3Si and a molecular weight of 216.35 g/mol. Its IUPAC name is propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate.

Molecular Properties

Compound Namepropyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate
PubChem CID174982118
Molecular FormulaC10H20O3Si
Molecular Weight216.35 g/mol
Exact Mass216.12
IUPAC Namepropyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate
SMILESCCCOC(=O)C(C)=C[SiH2]OC(C)C
InChIInChI=1S/C10H20O3Si/c1-5-6-12-10(11)9(4)7-14-13-8(2)3/h7-8H,5-6,14H2,1-4H3
InChIKeyOXKUXIQUNMHBSW-UHFFFAOYSA-N
XLogP1.35
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

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propyl (E)-2-methylhept-2-enoate
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butyl (E)-5-hydroxy-2-methyl-4-oxohex-2-enoate
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dipropyl (Z)-2-methyl-3-(2-methylpropyl)but-2-enedioate
CID 88549607
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CID 57110503

Frequently Asked Questions

What is the IUPAC name of propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate?
The IUPAC name of propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate (CID 174982118) is propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate.
What is the SMILES notation for propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate?
The canonical SMILES for propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate is CCCOC(=O)C(C)=C[SiH2]OC(C)C.
What is the InChIKey of propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate?
The InChIKey is OXKUXIQUNMHBSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3Si/c1-5-6-12-10(11)9(4)7-14-13-8(2)3/h7-8H,5-6,14H2,1-4H3.
What are the key properties of propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate?
propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate has a molecular weight of 216.35 g/mol, XLogP of 1.35, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propyl 2-methyl-3-propan-2-yloxysilylprop-2-enoate is sourced from PubChem (CID 174982118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).