Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID001130

Phytochemical name: 2-aminoethyl Acetate

Synonymous chemical names:
o-acetylethanolamine, 2-aminoethyl acetate

External chemical identifiers:
CID:CID_112720, ChEBI:CHEBI:173361, ZINC:ZINC000005161331, SureChEMBL:SCHEMBL833988

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Chemical structure information

SMILES:
CC(=O)OCCN

InChI:
InChI=1S/C4H9NO2/c1-4(6)7-3-2-5/h2-3,5H2,1H3

InChIKey:
HBVZRPAKZOLBPL-UHFFFAOYSA-N

DeepSMILES:
CC=O)OCCN

Functional groups:
COC(C)=O, CN

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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-Likeness score: 1.158

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Chemical structure download