Summary

IMPPAT Phytochemical identifier: IMPHY007145

Phytochemical name: Acrylic acid

Synonymous chemical names:
acrylic acid, acrylic-acid

External chemical identifiers:
CID:6581, ChEMBL:CHEMBL1213529, ChEBI:18308, ZINC:ZINC000000895281, FDASRS:J94PBK7X8S, SureChEMBL:SCHEMBL4482, MolPort-000-871-611

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Chemical structure information

SMILES:
OC(=O)C=C

InChI:
InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)

InChIKey:
NIXOWILDQLNWCW-UHFFFAOYSA-N

DeepSMILES:
OC=O)C=C

Functional groups:
C=CC(=O)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: Acrylic acids and derivatives

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Unsaturated fatty acids

NP-Likeness score: 1.116

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Chemical structure download