tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane

C13H28Si — CID 102273769

IUPACtert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane
SMILESCC(C)[C@@H](C)/C=C/[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28Si/c1-11(2)12(3)9-10-14(7,8)13(4,5)6/h9-12H,1-8H3/b10-9+/t12-/m0/s1
InChIKeyBKEGHAILYKOYBJ-VMPCVLLUSA-N
MW212.45 g/mol
LogP4.88
Rot. Bonds3

About tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane

tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane (PubChem CID 102273769) has the molecular formula C13H28Si and a molecular weight of 212.45 g/mol. Its IUPAC name is tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane
PubChem CID102273769
Molecular FormulaC13H28Si
Molecular Weight212.45 g/mol
Exact Mass212.20
IUPAC Nametert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane
SMILESCC(C)[C@@H](C)/C=C/[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28Si/c1-11(2)12(3)9-10-14(7,8)13(4,5)6/h9-12H,1-8H3/b10-9+/t12-/m0/s1
InChIKeyBKEGHAILYKOYBJ-VMPCVLLUSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.45
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E,6R)-2,3,6,7-tetramethyloct-4-ene
CID 58933362
(E)-3-[tert-butyl(dimethyl)silyl]-1-phenylprop-2-en-1-ol
CID 10922912
(Z,5R)-2,5,6-trimethylhept-3-ene
CID 155647530
ethyl (E,2R)-4-[tert-butyl(dimethyl)silyl]-2-hydroxybut-3-enoate
CID 125476530
3-bromoprop-1-enyl-tert-butyl-dimethylsilane
CID 71422698
tert-butyl-dimethyl-[(E)-3,4,4-trimethylpent-1-enoxy]silane
CID 101149922
methyl (E)-5-[tert-butyl(dimethyl)silyl]-2,2-dimethyl-3-phenylpent-4-enoate
CID 101122467
tert-butyl-[(E)-3-[tert-butyl(dimethyl)silyl]prop-1-enyl]-dimethylsilane
CID 12977713
(E)-4-[tert-butyl(dimethyl)silyl]but-3-en-2-one
CID 10511716
[(E)-3-[tert-butyl(dimethyl)silyl]-1-methoxyprop-2-enylidene]chromium
CID 12063120
3,4,7,8-tetramethylnona-1,5-diene
CID 123537739
(Z,4R)-N,2,2,7,8-pentamethylnon-5-en-4-amine
CID 137429083

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane?
The IUPAC name of tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane (CID 102273769) is tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane is CC(C)[C@@H](C)/C=C/[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane?
The InChIKey is BKEGHAILYKOYBJ-VMPCVLLUSA-N. The full InChI is InChI=1S/C13H28Si/c1-11(2)12(3)9-10-14(7,8)13(4,5)6/h9-12H,1-8H3/b10-9+/t12-/m0/s1.
What are the key properties of tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane?
tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane has a molecular weight of 212.45 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane is sourced from PubChem (CID 102273769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).