Summary

IMPPAT Phytochemical identifier: IMPHY017170

Phytochemical name: 2-Ethoxybutane

Synonymous chemical names:
butane,2-ethoxy-

External chemical identifiers:
CID:17586, FDASRS:9NHX6V19XI, SureChEMBL:SCHEMBL157863, MolPort-001-783-175

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Chemical structure information

SMILES:
CCOC(CC)C

InChI:
InChI=1S/C6H14O/c1-4-6(3)7-5-2/h6H,4-5H2,1-3H3

InChIKey:
VSCUCHUDCLERMY-UHFFFAOYSA-N

DeepSMILES:
CCOCCC))C

Functional groups:
COC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Ethers

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: -0.051

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Chemical structure download