propyl 2-silylprop-2-enoate

C6H12O2Si — CID 173152802

IUPACpropyl 2-silylprop-2-enoate
SMILESC=C([SiH3])C(=O)OCCC
InChIInChI=1S/C6H12O2Si/c1-3-4-8-6(7)5(2)9/h2-4H2,1,9H3
InChIKeySMVMLYVINJJFEE-UHFFFAOYSA-N
MW144.25 g/mol
LogP-0.18
Rot. Bonds3

About propyl 2-silylprop-2-enoate

propyl 2-silylprop-2-enoate (PubChem CID 173152802) has the molecular formula C6H12O2Si and a molecular weight of 144.25 g/mol. Its IUPAC name is propyl 2-silylprop-2-enoate.

Molecular Properties

Compound Namepropyl 2-silylprop-2-enoate
PubChem CID173152802
Molecular FormulaC6H12O2Si
Molecular Weight144.25 g/mol
Exact Mass144.06
IUPAC Namepropyl 2-silylprop-2-enoate
SMILESC=C([SiH3])C(=O)OCCC
InChIInChI=1S/C6H12O2Si/c1-3-4-8-6(7)5(2)9/h2-4H2,1,9H3
InChIKeySMVMLYVINJJFEE-UHFFFAOYSA-N
XLogP-0.18
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.25
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

propyl 2-bromoprop-2-enoate
CID 71576373
azane;propyl 2-methylprop-2-enoate
CID 172812841
2-O-[2-(2-methylprop-2-enoyloxy)ethyl] 1-O-propyl oxalate
CID 153485149
propyl 2-(sulfanylmethyl)prop-2-enoate
CID 87734128
propane;propyl 2-methylprop-2-enoate;yttrium
CID 158346337
1-O-ethyl 2-O-propyl oxalate
CID 6420312
butyl 2-methylprop-2-enoate;ethoxysilane;propyl 2-methylprop-2-enoate
CID 175326271
propyl 4-hydroxy-2-methylidenepentanoate
CID 88746999
propyl 2-octoxyprop-2-enoate
CID 139651501
dodecyl 2-methylprop-2-enoate;propyl 2-methylprop-2-enoate
CID 87150170
N-ethyl-N-methylethanamine;propyl 2-methylprop-2-enoate
CID 172705109
1-O-methyl 6-O-propyl (Z)-2,5-dimethylidenehex-3-enedioate
CID 140963717

Frequently Asked Questions

What is the IUPAC name of propyl 2-silylprop-2-enoate?
The IUPAC name of propyl 2-silylprop-2-enoate (CID 173152802) is propyl 2-silylprop-2-enoate.
What is the SMILES notation for propyl 2-silylprop-2-enoate?
The canonical SMILES for propyl 2-silylprop-2-enoate is C=C([SiH3])C(=O)OCCC.
What is the InChIKey of propyl 2-silylprop-2-enoate?
The InChIKey is SMVMLYVINJJFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2Si/c1-3-4-8-6(7)5(2)9/h2-4H2,1,9H3.
What are the key properties of propyl 2-silylprop-2-enoate?
propyl 2-silylprop-2-enoate has a molecular weight of 144.25 g/mol, XLogP of -0.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propyl 2-silylprop-2-enoate is sourced from PubChem (CID 173152802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).