CID 166063430

C7H14O2Si — CID 166063430

IUPAC—
SMILESCCCCOCC1CO1.[Si]
InChIInChI=1S/C7H14O2.Si/c1-2-3-4-8-5-7-6-9-7;/h7H,2-6H2,1H3;
InChIKeySJQNLERTOLNDOF-UHFFFAOYSA-N
MW158.27 g/mol
LogP0.82
Rot. Bonds5

About CID 166063430

CID 166063430 (PubChem CID 166063430) has the molecular formula C7H14O2Si and a molecular weight of 158.27 g/mol.

Molecular Properties

Compound NameCID 166063430
PubChem CID166063430
Molecular FormulaC7H14O2Si
Molecular Weight158.27 g/mol
Exact Mass158.08
IUPAC Name—
SMILESCCCCOCC1CO1.[Si]
InChIInChI=1S/C7H14O2.Si/c1-2-3-4-8-5-7-6-9-7;/h7H,2-6H2,1H3;
InChIKeySJQNLERTOLNDOF-UHFFFAOYSA-N
XLogP0.82
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.27
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2-(pentoxymethyl)oxirane
CID 160890113
2-(decoxymethyl)oxirane;2-(nonoxymethyl)oxirane;2-(octoxymethyl)oxirane
CID 71311396
2-(octoxymethyl)oxirane;2-(tetradecoxymethyl)oxirane
CID 174518537
2-(hexoxymethyl)oxirane;2-(pentoxymethyl)oxirane
CID 159895637
2-(tricosoxymethyl)oxirane
CID 57227005
(2S)-2-(octoxymethyl)oxirane
CID 87274801
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-nonoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 71327488
2-[2-(2-tetradecoxyethoxy)ethoxymethyl]oxirane
CID 86199119
2-(butoxymethyl)oxirane;2-[(2-methylpropan-2-yl)oxymethyl]oxirane
CID 161498038
2-(butoxymethyl)oxirane;oxonane
CID 20569142
2-(propoxymethyl)oxirane
CID 18406
2-(butoxymethyl)oxirane;2-ethyloxirane;fluoroform;propane
CID 174860691

Frequently Asked Questions

What is the IUPAC name of CID 166063430?
The IUPAC name of CID 166063430 (CID 166063430) is not available.
What is the SMILES notation for CID 166063430?
The canonical SMILES for CID 166063430 is CCCCOCC1CO1.[Si].
What is the InChIKey of CID 166063430?
The InChIKey is SJQNLERTOLNDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2.Si/c1-2-3-4-8-5-7-6-9-7;/h7H,2-6H2,1H3;.
What are the key properties of CID 166063430?
CID 166063430 has a molecular weight of 158.27 g/mol, XLogP of 0.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 166063430 is sourced from PubChem (CID 166063430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).