1,3,4-trimethyl-1-silanyliacyclopent-3-ene

C7H15Si+ — CID 101418613

IUPAC1,3,4-trimethyl-1-silanyliacyclopent-3-ene
SMILESCC1=C(C)C[SiH2+](C)C1
InChIInChI=1S/C7H15Si/c1-6-4-8(3)5-7(6)2/h4-5,8H2,1-3H3/q+1
InChIKeyKSJJUMUAFMDYPR-UHFFFAOYSA-N
MW127.28 g/mol
LogP1.93
Rot. Bonds

About 1,3,4-trimethyl-1-silanyliacyclopent-3-ene

1,3,4-trimethyl-1-silanyliacyclopent-3-ene (PubChem CID 101418613) has the molecular formula C7H15Si+ and a molecular weight of 127.28 g/mol. Its IUPAC name is 1,3,4-trimethyl-1-silanyliacyclopent-3-ene.

Molecular Properties

Compound Name1,3,4-trimethyl-1-silanyliacyclopent-3-ene
PubChem CID101418613
Molecular FormulaC7H15Si+
Molecular Weight127.28 g/mol
Exact Mass127.09
IUPAC Name1,3,4-trimethyl-1-silanyliacyclopent-3-ene
SMILESCC1=C(C)C[SiH2+](C)C1
InChIInChI=1S/C7H15Si/c1-6-4-8(3)5-7(6)2/h4-5,8H2,1-3H3/q+1
InChIKeyKSJJUMUAFMDYPR-UHFFFAOYSA-N
XLogP1.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.28
LogP ≤ 51.93
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 1,3,4-trimethyl-1-silanyliacyclopent-3-ene?
The IUPAC name of 1,3,4-trimethyl-1-silanyliacyclopent-3-ene (CID 101418613) is 1,3,4-trimethyl-1-silanyliacyclopent-3-ene.
What is the SMILES notation for 1,3,4-trimethyl-1-silanyliacyclopent-3-ene?
The canonical SMILES for 1,3,4-trimethyl-1-silanyliacyclopent-3-ene is CC1=C(C)C[SiH2+](C)C1.
What is the InChIKey of 1,3,4-trimethyl-1-silanyliacyclopent-3-ene?
The InChIKey is KSJJUMUAFMDYPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15Si/c1-6-4-8(3)5-7(6)2/h4-5,8H2,1-3H3/q+1.
What are the key properties of 1,3,4-trimethyl-1-silanyliacyclopent-3-ene?
1,3,4-trimethyl-1-silanyliacyclopent-3-ene has a molecular weight of 127.28 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4-trimethyl-1-silanyliacyclopent-3-ene is sourced from PubChem (CID 101418613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).