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

C9H19FSi — CID 13065753

IUPAC[(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane
SMILESCC(C)[C@@H](C)/C=C/[Si](C)(C)F
InChIInChI=1S/C9H19FSi/c1-8(2)9(3)6-7-11(4,5)10/h6-9H,1-5H3/b7-6+/t9-/m0/s1
InChIKeyIBZRMPHSYHSDFK-UCUJLANTSA-N
MW174.33 g/mol
LogP3.55
Rot. Bonds3

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

[(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane (PubChem CID 13065753) has the molecular formula C9H19FSi and a molecular weight of 174.33 g/mol. Its IUPAC name is [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane.

Molecular Properties

Compound Name[(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane
PubChem CID13065753
Molecular FormulaC9H19FSi
Molecular Weight174.33 g/mol
Exact Mass174.12
IUPAC Name[(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane
SMILESCC(C)[C@@H](C)/C=C/[Si](C)(C)F
InChIInChI=1S/C9H19FSi/c1-8(2)9(3)6-7-11(4,5)10/h6-9H,1-5H3/b7-6+/t9-/m0/s1
InChIKeyIBZRMPHSYHSDFK-UCUJLANTSA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.33
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(E,3R)-3,4-dimethylpent-1-enyl]-dimethylsilane
CID 102273769
[(E)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane
CID 5367128
Triethyl(3-methylpent-4-enyl)silane
CID 166067224
trimethyl-[(Z)-3-methylbut-1-enyl]silane
CID 12586609
tert-butyl-dimethyl-[(E)-pent-1-enyl]silane
CID 15325988
(E)-triethyl(4-methylpent-1-en-1-yl)silane
CID 122203884
tri(propan-2-yl)-[(E)-3,4,4-trimethylpent-1-enyl]silane
CID 134856168
Tert-butyl-dimethyl-pent-4-en-2-ylsilane
CID 134876061
Trimethyl(3-methylpent-4-en-2-yl)silane
CID 134980026
Tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane
CID 135080550
Fluoro-(2-methylpent-4-enyl)-di(propan-2-yl)silane
CID 10488941
Chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane
CID 102281589

Frequently Asked Questions

What is the IUPAC name of [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane?
The IUPAC name of [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane (CID 13065753) is [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane.
What is the SMILES notation for [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane?
The canonical SMILES for [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane is CC(C)[C@@H](C)/C=C/[Si](C)(C)F.
What is the InChIKey of [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane?
The InChIKey is IBZRMPHSYHSDFK-UCUJLANTSA-N. The full InChI is InChI=1S/C9H19FSi/c1-8(2)9(3)6-7-11(4,5)10/h6-9H,1-5H3/b7-6+/t9-/m0/s1.
What are the key properties of [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane?
[(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane has a molecular weight of 174.33 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,3R)-3,4-dimethylpent-1-enyl]-fluoro-dimethylsilane is sourced from PubChem (CID 13065753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).