1-ethylsilinane;2-methylthiophene

C12H22SSi — CID 174872127

IUPAC1-ethylsilinane;2-methylthiophene
SMILESCC[SiH]1CCCCC1.Cc1cccs1
InChIInChI=1S/C7H16Si.C5H6S/c1-2-8-6-4-3-5-7-8;1-5-3-2-4-6-5/h8H,2-7H2,1H3;2-4H,1H3
InChIKeyUZPNSPZQHNSJHM-UHFFFAOYSA-N
MW226.46 g/mol
LogP4.47
Rot. Bonds1

About 1-ethylsilinane;2-methylthiophene

1-ethylsilinane;2-methylthiophene (PubChem CID 174872127) has the molecular formula C12H22SSi and a molecular weight of 226.46 g/mol. Its IUPAC name is 1-ethylsilinane;2-methylthiophene.

Molecular Properties

Compound Name1-ethylsilinane;2-methylthiophene
PubChem CID174872127
Molecular FormulaC12H22SSi
Molecular Weight226.46 g/mol
Exact Mass226.12
IUPAC Name1-ethylsilinane;2-methylthiophene
SMILESCC[SiH]1CCCCC1.Cc1cccs1
InChIInChI=1S/C7H16Si.C5H6S/c1-2-8-6-4-3-5-7-8;1-5-3-2-4-6-5/h8H,2-7H2,1H3;2-4H,1H3
InChIKeyUZPNSPZQHNSJHM-UHFFFAOYSA-N
XLogP4.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.46
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-ethylsilinane;2-methylthiophene?
The IUPAC name of 1-ethylsilinane;2-methylthiophene (CID 174872127) is 1-ethylsilinane;2-methylthiophene.
What is the SMILES notation for 1-ethylsilinane;2-methylthiophene?
The canonical SMILES for 1-ethylsilinane;2-methylthiophene is CC[SiH]1CCCCC1.Cc1cccs1.
What is the InChIKey of 1-ethylsilinane;2-methylthiophene?
The InChIKey is UZPNSPZQHNSJHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16Si.C5H6S/c1-2-8-6-4-3-5-7-8;1-5-3-2-4-6-5/h8H,2-7H2,1H3;2-4H,1H3.
What are the key properties of 1-ethylsilinane;2-methylthiophene?
1-ethylsilinane;2-methylthiophene has a molecular weight of 226.46 g/mol, XLogP of 4.47, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylsilinane;2-methylthiophene is sourced from PubChem (CID 174872127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).