trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane

C13H26O3Si — CID 134894371

IUPACtrimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane
SMILESC=CC[C@H](CC1CO1)OCOCC[Si](C)(C)C
InChIInChI=1S/C13H26O3Si/c1-5-6-12(9-13-10-15-13)16-11-14-7-8-17(2,3)4/h5,12-13H,1,6-11H2,2-4H3/t12-,13?/m1/s1
InChIKeyAGVPQHWYRPXYMJ-PZORYLMUSA-N
MW258.43 g/mol
LogP3.05
Rot. Bonds10

About trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane

trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane (PubChem CID 134894371) has the molecular formula C13H26O3Si and a molecular weight of 258.43 g/mol. Its IUPAC name is trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane
PubChem CID134894371
Molecular FormulaC13H26O3Si
Molecular Weight258.43 g/mol
Exact Mass258.17
IUPAC Nametrimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane
SMILESC=CC[C@H](CC1CO1)OCOCC[Si](C)(C)C
InChIInChI=1S/C13H26O3Si/c1-5-6-12(9-13-10-15-13)16-11-14-7-8-17(2,3)4/h5,12-13H,1,6-11H2,2-4H3/t12-,13?/m1/s1
InChIKeyAGVPQHWYRPXYMJ-PZORYLMUSA-N
XLogP3.05
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-dimethyl-[(2S)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 10332001
tert-butyl-dimethyl-[(2R)-1-[(2R)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 10705360
tert-butyl-dimethyl-[(2S)-1-[(2R)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 11564984
tert-butyl-dimethyl-[(2R)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 13895986
trimethyl-[2-[[(2R)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxymethoxy]ethyl]silane
CID 13969334
tert-butyl-[(2S,4S)-4-(methoxymethoxy)hept-6-en-2-yl]oxy-dimethylsilane
CID 46218224
tert-butyl-[(4R)-4-(methoxymethoxy)hept-6-enoxy]-dimethylsilane
CID 11781213
tert-butyl-[(4S,6S)-6-(methoxymethoxy)hept-1-en-4-yl]oxy-dimethylsilane
CID 45378999
(2S)-2-[(2S)-2-(methoxymethoxy)pent-4-enyl]oxirane
CID 46844230
tert-butyl-[(1R,2R)-1-(methoxymethoxy)-1-[(2R)-oxiran-2-yl]but-3-en-2-yl]oxy-dimethylsilane
CID 71819357
tert-butyl-[(2R,4S)-4-(methoxymethoxy)hept-6-en-2-yl]oxy-dimethylsilane
CID 101387430

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane (CID 134894371) is trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane is C=CC[C@H](CC1CO1)OCOCC[Si](C)(C)C.
What is the InChIKey of trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane?
The InChIKey is AGVPQHWYRPXYMJ-PZORYLMUSA-N. The full InChI is InChI=1S/C13H26O3Si/c1-5-6-12(9-13-10-15-13)16-11-14-7-8-17(2,3)4/h5,12-13H,1,6-11H2,2-4H3/t12-,13?/m1/s1.
What are the key properties of trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane?
trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane has a molecular weight of 258.43 g/mol, XLogP of 3.05, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[(2R)-1-(oxiran-2-yl)pent-4-en-2-yl]oxymethoxy]ethyl]silane is sourced from PubChem (CID 134894371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).