(2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane

C23H48OSi — CID 141475322

IUPAC(2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane
SMILESCO[Si](C)(C)C(C)(C1CCCCC1)C(C)(C)C(C)(C)C(C)(C)C(C)C
InChIInChI=1S/C23H48OSi/c1-18(2)20(3,4)21(5,6)22(7,8)23(9,25(11,12)24-10)19-16-14-13-15-17-19/h18-19H,13-17H2,1-12H3
InChIKeyIIIAONFTNSFZEP-UHFFFAOYSA-N
MW368.72 g/mol
LogP7.91
Rot. Bonds7

About (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane

(2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane (PubChem CID 141475322) has the molecular formula C23H48OSi and a molecular weight of 368.72 g/mol. Its IUPAC name is (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane.

Molecular Properties

Compound Name(2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane
PubChem CID141475322
Molecular FormulaC23H48OSi
Molecular Weight368.72 g/mol
Exact Mass368.35
IUPAC Name(2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane
SMILESCO[Si](C)(C)C(C)(C1CCCCC1)C(C)(C)C(C)(C)C(C)(C)C(C)C
InChIInChI=1S/C23H48OSi/c1-18(2)20(3,4)21(5,6)22(7,8)23(9,25(11,12)24-10)19-16-14-13-15-17-19/h18-19H,13-17H2,1-12H3
InChIKeyIIIAONFTNSFZEP-UHFFFAOYSA-N
XLogP7.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.72
LogP ≤ 57.91
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-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane?
The IUPAC name of (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane (CID 141475322) is (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane.
What is the SMILES notation for (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane?
The canonical SMILES for (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane is CO[Si](C)(C)C(C)(C1CCCCC1)C(C)(C)C(C)(C)C(C)(C)C(C)C.
What is the InChIKey of (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane?
The InChIKey is IIIAONFTNSFZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48OSi/c1-18(2)20(3,4)21(5,6)22(7,8)23(9,25(11,12)24-10)19-16-14-13-15-17-19/h18-19H,13-17H2,1-12H3.
What are the key properties of (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane?
(2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane has a molecular weight of 368.72 g/mol, XLogP of 7.91, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-3,3,4,4,5,5,6-heptamethylheptan-2-yl)-methoxy-dimethylsilane is sourced from PubChem (CID 141475322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).