CID 18990598

C13H27O2Si — CID 18990598

IUPAC—
SMILESCC(C)O[Si](CC1CCCCC1)OC(C)C
InChIInChI=1S/C13H27O2Si/c1-11(2)14-16(15-12(3)4)10-13-8-6-5-7-9-13/h11-13H,5-10H2,1-4H3
InChIKeyVCNNMBOREIONTN-UHFFFAOYSA-N
MW243.44 g/mol
LogP3.90
Rot. Bonds6

About CID 18990598

CID 18990598 (PubChem CID 18990598) has the molecular formula C13H27O2Si and a molecular weight of 243.44 g/mol.

Molecular Properties

Compound NameCID 18990598
PubChem CID18990598
Molecular FormulaC13H27O2Si
Molecular Weight243.44 g/mol
Exact Mass243.18
IUPAC Name—
SMILESCC(C)O[Si](CC1CCCCC1)OC(C)C
InChIInChI=1S/C13H27O2Si/c1-11(2)14-16(15-12(3)4)10-13-8-6-5-7-9-13/h11-13H,5-10H2,1-4H3
InChIKeyVCNNMBOREIONTN-UHFFFAOYSA-N
XLogP3.90
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.44
LogP ≤ 53.90
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

CID 11789967
CID 11789967
(2-Cyclohexylethyl)(dimethoxy)silane
CID 57347865
Silane, diethylpropoxy(trans-4-methylcyclohexyloxy)-
CID 91714755
Cyclohexylmethyl(dimethoxy)silane
CID 3084281
2-Cyclohexylethyl-diethoxy-methylsilane
CID 13166986
Triethoxy-(1-methylcyclohexyl)silane
CID 18000014
CID 18388519
CID 18388519
Butyl-(cyclohexylmethyl)-diethoxysilane
CID 18412997
Cyclohexylmethyl-diethoxy-methylsilane
CID 18413028
Cyclohexylmethyl-diethoxy-propan-2-ylsilane
CID 18413037
CID 18990636
CID 18990636
CID 18990661
CID 18990661

Frequently Asked Questions

What is the IUPAC name of CID 18990598?
The IUPAC name of CID 18990598 (CID 18990598) is not available.
What is the SMILES notation for CID 18990598?
The canonical SMILES for CID 18990598 is CC(C)O[Si](CC1CCCCC1)OC(C)C.
What is the InChIKey of CID 18990598?
The InChIKey is VCNNMBOREIONTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27O2Si/c1-11(2)14-16(15-12(3)4)10-13-8-6-5-7-9-13/h11-13H,5-10H2,1-4H3.
What are the key properties of CID 18990598?
CID 18990598 has a molecular weight of 243.44 g/mol, XLogP of 3.90, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18990598 is sourced from PubChem (CID 18990598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).