2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane

C20H46OSi2 — CID 123962570

IUPAC2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane
SMILESCCC(C)(O[Si](C)(C)C(C)(CC)C(C)(C)CC(C)(C)C)[SiH](C)C
InChIInChI=1S/C20H46OSi2/c1-14-19(8,18(6,7)16-17(3,4)5)23(12,13)21-20(9,15-2)22(10)11/h22H,14-16H2,1-13H3
InChIKeyJTMRJYHUWGBWAP-UHFFFAOYSA-N
MW358.76 g/mol
LogP7.04
Rot. Bonds8

About 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane

2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane (PubChem CID 123962570) has the molecular formula C20H46OSi2 and a molecular weight of 358.76 g/mol. Its IUPAC name is 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane.

Molecular Properties

Compound Name2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane
PubChem CID123962570
Molecular FormulaC20H46OSi2
Molecular Weight358.76 g/mol
Exact Mass358.31
IUPAC Name2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane
SMILESCCC(C)(O[Si](C)(C)C(C)(CC)C(C)(C)CC(C)(C)C)[SiH](C)C
InChIInChI=1S/C20H46OSi2/c1-14-19(8,18(6,7)16-17(3,4)5)23(12,13)21-20(9,15-2)22(10)11/h22H,14-16H2,1-13H3
InChIKeyJTMRJYHUWGBWAP-UHFFFAOYSA-N
XLogP7.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.76
LogP ≤ 57.04
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 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane?
The IUPAC name of 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane (CID 123962570) is 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane.
What is the SMILES notation for 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane?
The canonical SMILES for 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane is CCC(C)(O[Si](C)(C)C(C)(CC)C(C)(C)CC(C)(C)C)[SiH](C)C.
What is the InChIKey of 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane?
The InChIKey is JTMRJYHUWGBWAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46OSi2/c1-14-19(8,18(6,7)16-17(3,4)5)23(12,13)21-20(9,15-2)22(10)11/h22H,14-16H2,1-13H3.
What are the key properties of 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane?
2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane has a molecular weight of 358.76 g/mol, XLogP of 7.04, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dimethylsilylbutan-2-yloxy-dimethyl-(3,4,4,6,6-pentamethylheptan-3-yl)silane is sourced from PubChem (CID 123962570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).