CID 155659371

C21H45O4Si2 — CID 155659371

IUPAC—
SMILESCCCCCC[Si](OC(=O)C(C)(CC)[Si](OC)OC)(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C21H45O4Si2/c1-12-14-15-16-17-27(19(3,4)5,20(6,7)8)25-18(22)21(9,13-2)26(23-10)24-11/h12-17H2,1-11H3
InChIKeyAZGIMVKNUWQMQX-UHFFFAOYSA-N
MW417.76 g/mol
LogP6.61
Rot. Bonds11

About CID 155659371

CID 155659371 (PubChem CID 155659371) has the molecular formula C21H45O4Si2 and a molecular weight of 417.76 g/mol.

Molecular Properties

Compound NameCID 155659371
PubChem CID155659371
Molecular FormulaC21H45O4Si2
Molecular Weight417.76 g/mol
Exact Mass417.29
IUPAC Name—
SMILESCCCCCC[Si](OC(=O)C(C)(CC)[Si](OC)OC)(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C21H45O4Si2/c1-12-14-15-16-17-27(19(3,4)5,20(6,7)8)25-18(22)21(9,13-2)26(23-10)24-11/h12-17H2,1-11H3
InChIKeyAZGIMVKNUWQMQX-UHFFFAOYSA-N
XLogP6.61
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.76
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

CID 155659279
CID 155659279
CID 155658998
CID 155658998
CID 155659478
CID 155659478
[ditert-butyl(pentyl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659210
tridodecylsilyl acetate
CID 22926548
[decyl-bis[(2,2,2-trifluoroacetyl)oxy]silyl] 2,2,2-trifluoroacetate
CID 175690446
tert-butyl-dimethoxy-tridecylsilane
CID 18990666
CID 155659170
CID 155659170
[tert-butyl(dimethyl)silyl] tetradecanoate
CID 528599
methyl 3-decyl-2,2-dimethyltridecanoate
CID 175420774
[tert-butyl(dimethyl)silyl] heptacosanoate
CID 91752633
(hexyl-methoxy-octadecanoyloxysilyl) octadecanoate
CID 175034042

Frequently Asked Questions

What is the IUPAC name of CID 155659371?
The IUPAC name of CID 155659371 (CID 155659371) is not available.
What is the SMILES notation for CID 155659371?
The canonical SMILES for CID 155659371 is CCCCCC[Si](OC(=O)C(C)(CC)[Si](OC)OC)(C(C)(C)C)C(C)(C)C.
What is the InChIKey of CID 155659371?
The InChIKey is AZGIMVKNUWQMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H45O4Si2/c1-12-14-15-16-17-27(19(3,4)5,20(6,7)8)25-18(22)21(9,13-2)26(23-10)24-11/h12-17H2,1-11H3.
What are the key properties of CID 155659371?
CID 155659371 has a molecular weight of 417.76 g/mol, XLogP of 6.61, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155659371 is sourced from PubChem (CID 155659371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).