hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane

C13H24O2Si — CID 71043343

IUPAChydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane
SMILESCc1ccc(CCCC(C)(C)[Si](C)(C)O)o1
InChIInChI=1S/C13H24O2Si/c1-11-8-9-12(15-11)7-6-10-13(2,3)16(4,5)14/h8-9,14H,6-7,10H2,1-5H3
InChIKeySKQRTZXSQGWKKG-UHFFFAOYSA-N
MW240.42 g/mol
LogP3.89
Rot. Bonds5

About hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane

hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane (PubChem CID 71043343) has the molecular formula C13H24O2Si and a molecular weight of 240.42 g/mol. Its IUPAC name is hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane.

Molecular Properties

Compound Namehydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane
PubChem CID71043343
Molecular FormulaC13H24O2Si
Molecular Weight240.42 g/mol
Exact Mass240.15
IUPAC Namehydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane
SMILESCc1ccc(CCCC(C)(C)[Si](C)(C)O)o1
InChIInChI=1S/C13H24O2Si/c1-11-8-9-12(15-11)7-6-10-13(2,3)16(4,5)14/h8-9,14H,6-7,10H2,1-5H3
InChIKeySKQRTZXSQGWKKG-UHFFFAOYSA-N
XLogP3.89
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane?
The IUPAC name of hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane (CID 71043343) is hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane.
What is the SMILES notation for hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane?
The canonical SMILES for hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane is Cc1ccc(CCCC(C)(C)[Si](C)(C)O)o1.
What is the InChIKey of hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane?
The InChIKey is SKQRTZXSQGWKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2Si/c1-11-8-9-12(15-11)7-6-10-13(2,3)16(4,5)14/h8-9,14H,6-7,10H2,1-5H3.
What are the key properties of hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane?
hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane has a molecular weight of 240.42 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-[2-methyl-5-(5-methylfuran-2-yl)pentan-2-yl]silane is sourced from PubChem (CID 71043343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).