(2-(Pentyloxy)ethyl)cyclohexane

HCID 41212

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Basic information

CAS: 54852-75-4
Standard SMILES: CCCCCOCCC1CCCCC1
InChIKey: SDQQSGSKFMYGII-UHFFFAOYSA-N
Molecular formula: C13H26O
Average molar mass: 198.34 g/mol
Monoisotopic mass: 198.19836545

Names & identifiers

Preferred name: (2-(Pentyloxy)ethyl)cyclohexane
IUPAC: 2-pentoxyethylcyclohexane
English name: (2-Pentyloxyethyl)cyclohexane
Molecular formula: C13H26O
Molecular weight: 198.34

Names & synonyms

54852-75-4(2-(PENTYLOXY)ETHYL)CYCLOHEXANE[2-(Pentyloxy)ethyl]cyclohexane(2-Pentyloxyethyl)cyclohexaneCyclohexane, [2-(pentyloxy)ethyl]-DTXSID80203335SDQQSGSKFMYGII-UHFFFAOYSA-N[2-(Pentyloxy)ethyl]cyclohexane #DB-309743

Database identifiers

CAS: 54852-75-4
PubChem CID: 41212
DTXSID: DTXSID80203335
Nikkaji: J102.214H

Properties

Computed structural properties

XLogP: 5
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 7
Heavy atoms: 14
Formal charge: 0
Complexity: 116

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