dibutoxy-(2-methylcyclopenten-1-yl)silane

C14H28O2Si — CID 123447319

IUPACdibutoxy-(2-methylcyclopenten-1-yl)silane
SMILESCCCCO[SiH](OCCCC)C1=C(C)CCC1
InChIInChI=1S/C14H28O2Si/c1-4-6-11-15-17(16-12-7-5-2)14-10-8-9-13(14)3/h17H,4-12H2,1-3H3
InChIKeyIDBQRGWHKXRIOM-UHFFFAOYSA-N
MW256.46 g/mol
LogP3.88
Rot. Bonds9

About dibutoxy-(2-methylcyclopenten-1-yl)silane

dibutoxy-(2-methylcyclopenten-1-yl)silane (PubChem CID 123447319) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is dibutoxy-(2-methylcyclopenten-1-yl)silane.

Molecular Properties

Compound Namedibutoxy-(2-methylcyclopenten-1-yl)silane
PubChem CID123447319
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Namedibutoxy-(2-methylcyclopenten-1-yl)silane
SMILESCCCCO[SiH](OCCCC)C1=C(C)CCC1
InChIInChI=1S/C14H28O2Si/c1-4-6-11-15-17(16-12-7-5-2)14-10-8-9-13(14)3/h17H,4-12H2,1-3H3
InChIKeyIDBQRGWHKXRIOM-UHFFFAOYSA-N
XLogP3.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-2-octoxycyclohexene
CID 70525122
didodecoxy(hydroxy)silane
CID 173157233
butoxy-hydroxy-[(2-methylpropan-2-yl)oxy]silane
CID 123276857
[2-(cyclohepten-1-yl)cyclohepten-1-yl]-dipropoxysilane
CID 172997536
1-butylperoxybutane;cyclooctane
CID 140991302
hydroxy-nonadecoxy-silylsilane
CID 173155856
dibutoxy(3-dibutoxysilylpropyl)silane
CID 123992864
1-butyl-2-methylcyclohexene;ethane
CID 145390002
N-dibutoxysilyl-N-methylmethanamine
CID 150941363
dihexadecoxy(phenyl)silane
CID 173048581
butyl 7-hydroxy-5,6-dimethyl-2,3-dihydro-1H-indene-4-carboxylate
CID 177152790
butyl 2-[2-(2-butoxy-2-oxoethyl)cyclohexen-1-yl]acetate
CID 19980675

Frequently Asked Questions

What is the IUPAC name of dibutoxy-(2-methylcyclopenten-1-yl)silane?
The IUPAC name of dibutoxy-(2-methylcyclopenten-1-yl)silane (CID 123447319) is dibutoxy-(2-methylcyclopenten-1-yl)silane.
What is the SMILES notation for dibutoxy-(2-methylcyclopenten-1-yl)silane?
The canonical SMILES for dibutoxy-(2-methylcyclopenten-1-yl)silane is CCCCO[SiH](OCCCC)C1=C(C)CCC1.
What is the InChIKey of dibutoxy-(2-methylcyclopenten-1-yl)silane?
The InChIKey is IDBQRGWHKXRIOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-4-6-11-15-17(16-12-7-5-2)14-10-8-9-13(14)3/h17H,4-12H2,1-3H3.
What are the key properties of dibutoxy-(2-methylcyclopenten-1-yl)silane?
dibutoxy-(2-methylcyclopenten-1-yl)silane has a molecular weight of 256.46 g/mol, XLogP of 3.88, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-(2-methylcyclopenten-1-yl)silane is sourced from PubChem (CID 123447319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).