CID 87587523

C18H35OSi — CID 87587523

IUPAC—
SMILESC[Si](C)O/C1=C/C(C(C)(C)C)CCCCCCCCC1
InChIInChI=1S/C18H35OSi/c1-18(2,3)16-13-11-9-7-6-8-10-12-14-17(15-16)19-20(4)5/h15-16H,6-14H2,1-5H3/b17-15+
InChIKeyBCSVNVLYTKDHRR-BMRADRMJSA-N
MW295.56 g/mol
LogP6.32
Rot. Bonds2

About CID 87587523

CID 87587523 (PubChem CID 87587523) has the molecular formula C18H35OSi and a molecular weight of 295.56 g/mol.

Molecular Properties

Compound NameCID 87587523
PubChem CID87587523
Molecular FormulaC18H35OSi
Molecular Weight295.56 g/mol
Exact Mass295.25
IUPAC Name—
SMILESC[Si](C)O/C1=C/C(C(C)(C)C)CCCCCCCCC1
InChIInChI=1S/C18H35OSi/c1-18(2,3)16-13-11-9-7-6-8-10-12-14-17(15-16)19-20(4)5/h15-16H,6-14H2,1-5H3/b17-15+
InChIKeyBCSVNVLYTKDHRR-BMRADRMJSA-N
XLogP6.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.56
LogP ≤ 56.32
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 CID 87587523?
The IUPAC name of CID 87587523 (CID 87587523) is not available.
What is the SMILES notation for CID 87587523?
The canonical SMILES for CID 87587523 is C[Si](C)O/C1=C/C(C(C)(C)C)CCCCCCCCC1.
What is the InChIKey of CID 87587523?
The InChIKey is BCSVNVLYTKDHRR-BMRADRMJSA-N. The full InChI is InChI=1S/C18H35OSi/c1-18(2,3)16-13-11-9-7-6-8-10-12-14-17(15-16)19-20(4)5/h15-16H,6-14H2,1-5H3/b17-15+.
What are the key properties of CID 87587523?
CID 87587523 has a molecular weight of 295.56 g/mol, XLogP of 6.32, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87587523 is sourced from PubChem (CID 87587523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).