chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane

C10H17ClSi — CID 59884244

IUPACchloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=C(C)C([SiH](C)Cl)C(C)=C1C
InChIInChI=1S/C10H17ClSi/c1-6-7(2)9(4)10(8(6)3)12(5)11/h10,12H,1-5H3
InChIKeyJBSHPEZQHAKVDQ-UHFFFAOYSA-N
MW200.78 g/mol
LogP3.64
Rot. Bonds1

About chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane

chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 59884244) has the molecular formula C10H17ClSi and a molecular weight of 200.78 g/mol. Its IUPAC name is chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Namechloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
PubChem CID59884244
Molecular FormulaC10H17ClSi
Molecular Weight200.78 g/mol
Exact Mass200.08
IUPAC Namechloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=C(C)C([SiH](C)Cl)C(C)=C1C
InChIInChI=1S/C10H17ClSi/c1-6-7(2)9(4)10(8(6)3)12(5)11/h10,12H,1-5H3
InChIKeyJBSHPEZQHAKVDQ-UHFFFAOYSA-N
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.78
LogP ≤ 53.64
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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Frequently Asked Questions

What is the IUPAC name of chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane (CID 59884244) is chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane is CC1=C(C)C([SiH](C)Cl)C(C)=C1C.
What is the InChIKey of chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is JBSHPEZQHAKVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClSi/c1-6-7(2)9(4)10(8(6)3)12(5)11/h10,12H,1-5H3.
What are the key properties of chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane?
chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 200.78 g/mol, XLogP of 3.64, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-methyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 59884244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).