lithium 2,5,5-trimethylhexan-2-yloxysilane

C9H21LiOSi — CID 173081062

IUPAClithium 2,5,5-trimethylhexan-2-yloxysilane
SMILESCC(C)(C)[CH-]CC(C)(C)O[SiH3].[Li+]
InChIInChI=1S/C9H21OSi.Li/c1-8(2,3)6-7-9(4,5)10-11;/h6H,7H2,1-5,11H3;/q-1;+1
InChIKeyDAPJAWSHLATTPL-UHFFFAOYSA-N
MW180.29 g/mol
LogP-1.29
Rot. Bonds3

About lithium 2,5,5-trimethylhexan-2-yloxysilane

lithium 2,5,5-trimethylhexan-2-yloxysilane (PubChem CID 173081062) has the molecular formula C9H21LiOSi and a molecular weight of 180.29 g/mol. Its IUPAC name is lithium 2,5,5-trimethylhexan-2-yloxysilane.

Molecular Properties

Compound Namelithium 2,5,5-trimethylhexan-2-yloxysilane
PubChem CID173081062
Molecular FormulaC9H21LiOSi
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Namelithium 2,5,5-trimethylhexan-2-yloxysilane
SMILESCC(C)(C)[CH-]CC(C)(C)O[SiH3].[Li+]
InChIInChI=1S/C9H21OSi.Li/c1-8(2,3)6-7-9(4,5)10-11;/h6H,7H2,1-5,11H3;/q-1;+1
InChIKeyDAPJAWSHLATTPL-UHFFFAOYSA-N
XLogP-1.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 5-1.29
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

2-methylicosan-2-yloxysilane
CID 173002328
CID 175267598
CID 175267598
dimethyl-(5-methyl-5-silyloxyhexyl)phosphane
CID 173465118
dimethyl-(4-methyl-4-silyloxypentyl)phosphane
CID 173465122
2-methylhex-4-en-2-yloxysilane
CID 175079784
5-methyl-5-silyloxyhexan-3-amine
CID 173027974
1,1-dichloroethoxysilane
CID 123382571
(6-chloro-2,5-dimethylhexan-2-yl)oxysilane
CID 173078768
(1-bromo-4,6,6-trimethylheptan-4-yl)oxysilane
CID 173367120
(2-methyl-2-silyloxypropyl)urea
CID 173059861
2,3,3-trimethylbutan-2-yloxysilane
CID 123420787
2-ethoxy-2-methylundecane
CID 150956805

Frequently Asked Questions

What is the IUPAC name of lithium 2,5,5-trimethylhexan-2-yloxysilane?
The IUPAC name of lithium 2,5,5-trimethylhexan-2-yloxysilane (CID 173081062) is lithium 2,5,5-trimethylhexan-2-yloxysilane.
What is the SMILES notation for lithium 2,5,5-trimethylhexan-2-yloxysilane?
The canonical SMILES for lithium 2,5,5-trimethylhexan-2-yloxysilane is CC(C)(C)[CH-]CC(C)(C)O[SiH3].[Li+].
What is the InChIKey of lithium 2,5,5-trimethylhexan-2-yloxysilane?
The InChIKey is DAPJAWSHLATTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21OSi.Li/c1-8(2,3)6-7-9(4,5)10-11;/h6H,7H2,1-5,11H3;/q-1;+1.
What are the key properties of lithium 2,5,5-trimethylhexan-2-yloxysilane?
lithium 2,5,5-trimethylhexan-2-yloxysilane has a molecular weight of 180.29 g/mol, XLogP of -1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2,5,5-trimethylhexan-2-yloxysilane is sourced from PubChem (CID 173081062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).