(2,4-dimethylcyclopenta-1,3-dien-1-yl)silane

C7H12Si — CID 154163824

IUPAC(2,4-dimethylcyclopenta-1,3-dien-1-yl)silane
SMILESCC1=CC(C)=C([SiH3])C1
InChIInChI=1S/C7H12Si/c1-5-3-6(2)7(8)4-5/h3H,4H2,1-2,8H3
InChIKeyYJYNVFAOBVUXSM-UHFFFAOYSA-N
MW124.26 g/mol
LogP0.98
Rot. Bonds

About (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane

(2,4-dimethylcyclopenta-1,3-dien-1-yl)silane (PubChem CID 154163824) has the molecular formula C7H12Si and a molecular weight of 124.26 g/mol. Its IUPAC name is (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane.

Molecular Properties

Compound Name(2,4-dimethylcyclopenta-1,3-dien-1-yl)silane
PubChem CID154163824
Molecular FormulaC7H12Si
Molecular Weight124.26 g/mol
Exact Mass124.07
IUPAC Name(2,4-dimethylcyclopenta-1,3-dien-1-yl)silane
SMILESCC1=CC(C)=C([SiH3])C1
InChIInChI=1S/C7H12Si/c1-5-3-6(2)7(8)4-5/h3H,4H2,1-2,8H3
InChIKeyYJYNVFAOBVUXSM-UHFFFAOYSA-N
XLogP0.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.26
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane?
The IUPAC name of (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane (CID 154163824) is (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane.
What is the SMILES notation for (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane?
The canonical SMILES for (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane is CC1=CC(C)=C([SiH3])C1.
What is the InChIKey of (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane?
The InChIKey is YJYNVFAOBVUXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12Si/c1-5-3-6(2)7(8)4-5/h3H,4H2,1-2,8H3.
What are the key properties of (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane?
(2,4-dimethylcyclopenta-1,3-dien-1-yl)silane has a molecular weight of 124.26 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylcyclopenta-1,3-dien-1-yl)silane is sourced from PubChem (CID 154163824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).