2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane

C12H20Si — CID 163212625

IUPAC2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane
SMILESC=C(CC1=CC=CC1)C[Si](C)(C)C
InChIInChI=1S/C12H20Si/c1-11(10-13(2,3)4)9-12-7-5-6-8-12/h5-7H,1,8-10H2,2-4H3
InChIKeyJSODIQSYFMSVDH-UHFFFAOYSA-N
MW192.38 g/mol
LogP4.16
Rot. Bonds4

About 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane

2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane (PubChem CID 163212625) has the molecular formula C12H20Si and a molecular weight of 192.38 g/mol. Its IUPAC name is 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane.

Molecular Properties

Compound Name2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane
PubChem CID163212625
Molecular FormulaC12H20Si
Molecular Weight192.38 g/mol
Exact Mass192.13
IUPAC Name2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane
SMILESC=C(CC1=CC=CC1)C[Si](C)(C)C
InChIInChI=1S/C12H20Si/c1-11(10-13(2,3)4)9-12-7-5-6-8-12/h5-7H,1,8-10H2,2-4H3
InChIKeyJSODIQSYFMSVDH-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.38
LogP ≤ 54.16
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 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane?
The IUPAC name of 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane (CID 163212625) is 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane.
What is the SMILES notation for 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane?
The canonical SMILES for 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane is C=C(CC1=CC=CC1)C[Si](C)(C)C.
What is the InChIKey of 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane?
The InChIKey is JSODIQSYFMSVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20Si/c1-11(10-13(2,3)4)9-12-7-5-6-8-12/h5-7H,1,8-10H2,2-4H3.
What are the key properties of 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane?
2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane has a molecular weight of 192.38 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenta-1,3-dien-1-ylmethyl)prop-2-enyl-trimethylsilane is sourced from PubChem (CID 163212625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).