2,2-diethoxyethyl(hex-5-enyl)silane

C12H26O2Si — CID 151959610

IUPAC2,2-diethoxyethyl(hex-5-enyl)silane
SMILESC=CCCCC[SiH2]CC(OCC)OCC
InChIInChI=1S/C12H26O2Si/c1-4-7-8-9-10-15-11-12(13-5-2)14-6-3/h4,12H,1,5-11,15H2,2-3H3
InChIKeyTYJCWIRKXCIQHD-UHFFFAOYSA-N
MW230.42 g/mol
LogP2.75
Rot. Bonds11

About 2,2-diethoxyethyl(hex-5-enyl)silane

2,2-diethoxyethyl(hex-5-enyl)silane (PubChem CID 151959610) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is 2,2-diethoxyethyl(hex-5-enyl)silane.

Molecular Properties

Compound Name2,2-diethoxyethyl(hex-5-enyl)silane
PubChem CID151959610
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name2,2-diethoxyethyl(hex-5-enyl)silane
SMILESC=CCCCC[SiH2]CC(OCC)OCC
InChIInChI=1S/C12H26O2Si/c1-4-7-8-9-10-15-11-12(13-5-2)14-6-3/h4,12H,1,5-11,15H2,2-3H3
InChIKeyTYJCWIRKXCIQHD-UHFFFAOYSA-N
XLogP2.75
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

12,12-diethoxydodec-1-ene
CID 146004846
3-(2,2-diethoxyethylsilyl)-N-hexylpropan-1-imine
CID 123811394
prop-2-enyl(undec-10-enyl)silane
CID 173097266
2-(2,2-diethoxyethylsilyl)ethyl prop-2-enoate
CID 154323498
N-[4-(2,2-diethoxyethylsilyl)butyl]-2-methylprop-2-enamide
CID 152696796
11-(1-ethoxyethoxy)undec-1-ene
CID 10900817
2,2-diethoxyethyl-[5-(oxiran-2-ylmethoxy)pentyl]silane
CID 150898745
2-ethoxyoct-7-en-3-ol
CID 64541753
1,1-diethoxyhept-6-en-2-ol
CID 79496437
2,2-diethoxyethyl-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 123713397
4-ethoxydodec-11-en-5-one
CID 107008392
3-[2-(2,2-diethoxyethylsilyl)ethoxy]-N,N-dimethylpropan-1-amine
CID 149250413

Frequently Asked Questions

What is the IUPAC name of 2,2-diethoxyethyl(hex-5-enyl)silane?
The IUPAC name of 2,2-diethoxyethyl(hex-5-enyl)silane (CID 151959610) is 2,2-diethoxyethyl(hex-5-enyl)silane.
What is the SMILES notation for 2,2-diethoxyethyl(hex-5-enyl)silane?
The canonical SMILES for 2,2-diethoxyethyl(hex-5-enyl)silane is C=CCCCC[SiH2]CC(OCC)OCC.
What is the InChIKey of 2,2-diethoxyethyl(hex-5-enyl)silane?
The InChIKey is TYJCWIRKXCIQHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-4-7-8-9-10-15-11-12(13-5-2)14-6-3/h4,12H,1,5-11,15H2,2-3H3.
What are the key properties of 2,2-diethoxyethyl(hex-5-enyl)silane?
2,2-diethoxyethyl(hex-5-enyl)silane has a molecular weight of 230.42 g/mol, XLogP of 2.75, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethoxyethyl(hex-5-enyl)silane is sourced from PubChem (CID 151959610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).