[6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane

C12H26Si — CID 173198462

IUPAC[6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane
SMILESC=CCC([SiH3])(CC(C)C)CC(C)C
InChIInChI=1S/C12H26Si/c1-6-7-12(13,8-10(2)3)9-11(4)5/h6,10-11H,1,7-9H2,2-5,13H3
InChIKeyNHPSEXHCKMNQNP-UHFFFAOYSA-N
MW198.43 g/mol
LogP3.18
Rot. Bonds6

About [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane

[6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane (PubChem CID 173198462) has the molecular formula C12H26Si and a molecular weight of 198.43 g/mol. Its IUPAC name is [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane.

Molecular Properties

Compound Name[6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane
PubChem CID173198462
Molecular FormulaC12H26Si
Molecular Weight198.43 g/mol
Exact Mass198.18
IUPAC Name[6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane
SMILESC=CCC([SiH3])(CC(C)C)CC(C)C
InChIInChI=1S/C12H26Si/c1-6-7-12(13,8-10(2)3)9-11(4)5/h6,10-11H,1,7-9H2,2-5,13H3
InChIKeyNHPSEXHCKMNQNP-UHFFFAOYSA-N
XLogP3.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.43
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane?
The IUPAC name of [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane (CID 173198462) is [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane.
What is the SMILES notation for [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane?
The canonical SMILES for [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane is C=CCC([SiH3])(CC(C)C)CC(C)C.
What is the InChIKey of [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane?
The InChIKey is NHPSEXHCKMNQNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26Si/c1-6-7-12(13,8-10(2)3)9-11(4)5/h6,10-11H,1,7-9H2,2-5,13H3.
What are the key properties of [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane?
[6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane has a molecular weight of 198.43 g/mol, XLogP of 3.18, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-4-(2-methylpropyl)hept-1-en-4-yl]silane is sourced from PubChem (CID 173198462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).