butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane

C14H32O2Si — CID 172844126

IUPACbutan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane
SMILESCCCC[Si](OC)(OCC(C)(C)C)C(C)CC
InChIInChI=1S/C14H32O2Si/c1-8-10-11-17(15-7,13(3)9-2)16-12-14(4,5)6/h13H,8-12H2,1-7H3
InChIKeyXENBFIDQRQDLEN-UHFFFAOYSA-N
MW260.49 g/mol
LogP4.74
Rot. Bonds8

About butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane

butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane (PubChem CID 172844126) has the molecular formula C14H32O2Si and a molecular weight of 260.49 g/mol. Its IUPAC name is butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane.

Molecular Properties

Compound Namebutan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane
PubChem CID172844126
Molecular FormulaC14H32O2Si
Molecular Weight260.49 g/mol
Exact Mass260.22
IUPAC Namebutan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane
SMILESCCCC[Si](OC)(OCC(C)(C)C)C(C)CC
InChIInChI=1S/C14H32O2Si/c1-8-10-11-17(15-7,13(3)9-2)16-12-14(4,5)6/h13H,8-12H2,1-7H3
InChIKeyXENBFIDQRQDLEN-UHFFFAOYSA-N
XLogP4.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.49
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

butan-2-yl-butyl-diethoxysilane
CID 23358225
butan-2-yl-dimethoxy-propylsilane
CID 22616756
3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane
CID 141219255
4-[butyl(dimethoxy)silyl]hexan-1-amine
CID 88812976
butyl-(2,2-dimethylpropyl)-ethoxy-methoxysilane
CID 141442950
di(butan-2-yloxy)-butyl-methoxysilane
CID 71349639
di(butan-2-yl)-dimethoxysilane
CID 11687104
di(butan-2-yloxy)-butyl-tert-butylsilane
CID 18990654
dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
CID 87144336
4-[butyl(dipropoxy)silyl]pentan-1-amine
CID 88812128
[dimethoxy(octadecan-2-yl)silyl]methanol
CID 140786840
decyl-(3-ethyl-2,4-dimethylpentan-2-yl)-dimethoxysilane
CID 151840194

Frequently Asked Questions

What is the IUPAC name of butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane?
The IUPAC name of butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane (CID 172844126) is butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane.
What is the SMILES notation for butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane?
The canonical SMILES for butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane is CCCC[Si](OC)(OCC(C)(C)C)C(C)CC.
What is the InChIKey of butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane?
The InChIKey is XENBFIDQRQDLEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-8-10-11-17(15-7,13(3)9-2)16-12-14(4,5)6/h13H,8-12H2,1-7H3.
What are the key properties of butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane?
butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane has a molecular weight of 260.49 g/mol, XLogP of 4.74, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl-butyl-(2,2-dimethylpropoxy)-methoxysilane is sourced from PubChem (CID 172844126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).