lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane

C16H31LiO2Si — CID 177486006

IUPAClithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane
SMILESCC[C@@H]1O[C-]=C[C@H]1CO[Si](C(C)C)(C(C)C)C(C)C.[Li+]
InChIInChI=1S/C16H31O2Si.Li/c1-8-16-15(9-10-17-16)11-18-19(12(2)3,13(4)5)14(6)7;/h9,12-16H,8,11H2,1-7H3;/q-1;+1/t15-,16-;/m0./s1
InChIKeyAOJYMWOZIJWKPV-MOGJOVFKSA-N
MW290.45 g/mol
LogP1.92
Rot. Bonds7

About lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane

lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane (PubChem CID 177486006) has the molecular formula C16H31LiO2Si and a molecular weight of 290.45 g/mol. Its IUPAC name is lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Namelithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane
PubChem CID177486006
Molecular FormulaC16H31LiO2Si
Molecular Weight290.45 g/mol
Exact Mass290.23
IUPAC Namelithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane
SMILESCC[C@@H]1O[C-]=C[C@H]1CO[Si](C(C)C)(C(C)C)C(C)C.[Li+]
InChIInChI=1S/C16H31O2Si.Li/c1-8-16-15(9-10-17-16)11-18-19(12(2)3,13(4)5)14(6)7;/h9,12-16H,8,11H2,1-7H3;/q-1;+1/t15-,16-;/m0./s1
InChIKeyAOJYMWOZIJWKPV-MOGJOVFKSA-N
XLogP1.92
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane with MolForge

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Related Compounds

lithium [(2R,3R)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane
CID 10446964
(2-Methyl-2,3-dihydrofuran-3-yl)methoxy-tri(propan-2-yl)silane
CID 142927109
[(2R,3R)-2-ethyl-2,3-dihydrofuran-3-yl]methoxy-tri(propan-2-yl)silane
CID 10039552
tert-butyl-[[(2R,3R)-2-ethyl-2,3-dihydrofuran-3-yl]methoxy]-dimethylsilane
CID 10354402
lithium tert-butyl-[[(2R,3R)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy]-dimethylsilane
CID 10422141
[(2S,3S)-2-ethyl-2,3-dihydrofuran-3-yl]methoxy-tri(propan-2-yl)silane
CID 101924656

Frequently Asked Questions

What is the IUPAC name of lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane?
The IUPAC name of lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane (CID 177486006) is lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane.
What is the SMILES notation for lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane?
The canonical SMILES for lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane is CC[C@@H]1O[C-]=C[C@H]1CO[Si](C(C)C)(C(C)C)C(C)C.[Li+].
What is the InChIKey of lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane?
The InChIKey is AOJYMWOZIJWKPV-MOGJOVFKSA-N. The full InChI is InChI=1S/C16H31O2Si.Li/c1-8-16-15(9-10-17-16)11-18-19(12(2)3,13(4)5)14(6)7;/h9,12-16H,8,11H2,1-7H3;/q-1;+1/t15-,16-;/m0./s1.
What are the key properties of lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane?
lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane has a molecular weight of 290.45 g/mol, XLogP of 1.92, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium [(2S,3S)-2-ethyl-3,5-dihydro-2H-furan-5-id-3-yl]methoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 177486006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).