lithium but-2-enoxy-tri(propan-2-yl)silane

C13H27LiOSi — CID 134870487

IUPAClithium but-2-enoxy-tri(propan-2-yl)silane
SMILESC/[C-]=C\CO[Si](C(C)C)(C(C)C)C(C)C.[Li+]
InChIInChI=1S/C13H27OSi.Li/c1-8-9-10-14-15(11(2)3,12(4)5)13(6)7;/h9,11-13H,10H2,1-7H3;/q-1;+1
InChIKeyXAVUVFCIANTMFW-UHFFFAOYSA-N
MW234.38 g/mol
LogP1.56
Rot. Bonds6

About lithium but-2-enoxy-tri(propan-2-yl)silane

lithium but-2-enoxy-tri(propan-2-yl)silane (PubChem CID 134870487) has the molecular formula C13H27LiOSi and a molecular weight of 234.38 g/mol. Its IUPAC name is lithium but-2-enoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Namelithium but-2-enoxy-tri(propan-2-yl)silane
PubChem CID134870487
Molecular FormulaC13H27LiOSi
Molecular Weight234.38 g/mol
Exact Mass234.20
IUPAC Namelithium but-2-enoxy-tri(propan-2-yl)silane
SMILESC/[C-]=C\CO[Si](C(C)C)(C(C)C)C(C)C.[Li+]
InChIInChI=1S/C13H27OSi.Li/c1-8-9-10-14-15(11(2)3,12(4)5)13(6)7;/h9,11-13H,10H2,1-7H3;/q-1;+1
InChIKeyXAVUVFCIANTMFW-UHFFFAOYSA-N
XLogP1.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.38
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Trimethylsiloxy-2-butene
CID 5366916
3,8-Dioxa-2,9-disiladec-5-ene, 2,2,9,9-tetramethyl-, (E)-
CID 5366600
trans-Crotyl alcohol, tert-butyldimethylsilyl ether
CID 11217677
Tert-butyldimethyl((3-methylbut-2-en-1-yl)oxy)silane
CID 11469722
Allyloxy(triethyl) silane
CID 575513
1-Dimethylisopropylsilyloxy-3-methylbut-2-ene
CID 531285
Prenol, TMS derivative
CID 6421205
But-2-enoxy(trimethyl)silane
CID 554664
(5Z)-2,2,9,9-Tetramethyl-3,8-dioxa-2,9-disiladec-5-ene
CID 5372908
Dimethyl(bis[(3-methylbut-2-en-1-yl)oxy])silane
CID 91697225
(5E)-5-ethylidene-2,2,4,4-tetramethyl-1,3,2,4-dioxadisilinane
CID 11241122
O-tert-Butyldimethylsilyl-3-iodo-(2E)-buten-1-ol
CID 11001446

Frequently Asked Questions

What is the IUPAC name of lithium but-2-enoxy-tri(propan-2-yl)silane?
The IUPAC name of lithium but-2-enoxy-tri(propan-2-yl)silane (CID 134870487) is lithium but-2-enoxy-tri(propan-2-yl)silane.
What is the SMILES notation for lithium but-2-enoxy-tri(propan-2-yl)silane?
The canonical SMILES for lithium but-2-enoxy-tri(propan-2-yl)silane is C/[C-]=C\CO[Si](C(C)C)(C(C)C)C(C)C.[Li+].
What is the InChIKey of lithium but-2-enoxy-tri(propan-2-yl)silane?
The InChIKey is XAVUVFCIANTMFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27OSi.Li/c1-8-9-10-14-15(11(2)3,12(4)5)13(6)7;/h9,11-13H,10H2,1-7H3;/q-1;+1.
What are the key properties of lithium but-2-enoxy-tri(propan-2-yl)silane?
lithium but-2-enoxy-tri(propan-2-yl)silane has a molecular weight of 234.38 g/mol, XLogP of 1.56, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium but-2-enoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 134870487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).