Summary

IMPPAT Phytochemical identifier: IMPHY015662

Phytochemical name: Ethyl formate

Synonymous chemical names:
ethyl formate, ethyl formate, ethyl formate b, ethyl formate*

External chemical identifiers:
CID:8025, ChEMBL:CHEMBL44215, ChEBI:52342, ZINC:ZINC000001648253, FDASRS:0K3E2L5553, SureChEMBL:SCHEMBL453, MolPort-001-766-723

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Chemical structure information

SMILES:
CCOC=O

InChI:
InChI=1S/C3H6O2/c1-2-5-3-4/h3H,2H2,1H3

InChIKey:
WBJINCZRORDGAQ-UHFFFAOYSA-N

DeepSMILES:
CCOC=O

Functional groups:
COC=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Carboxylic acid derivatives

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty esters

NP Classifier Class: Wax monoesters

NP-Likeness score: 0.708

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Chemical structure download