EcoDrugPlus


Keyword(s):	Plastic additives ; Food Contact Chemicals
Molecule Category	Salt-form
UNII	4720M0PK19
EPA CompTox	DTXSID1027768

Keyword(s):

Plastic additives ; Food Contact Chemicals

Molecule Category

Salt-form

UNII

4720M0PK19

EPA CompTox

DTXSID1027768


InChI Key	XKMZOFXGLBYJLS-UHFFFAOYSA-L
Smiles	[Zn+2].[O-]C(=O)C=C.[O-]C(=O)C=C
InChI	InChI=1/2C3H4O2.Zn/c21-2-3(4)5;/h22H,1H2,(H,4,5);/q;;+2/p-2

InChI Key

XKMZOFXGLBYJLS-UHFFFAOYSA-L

Smiles

[Zn+2].[O-]C(=O)C=C.[O-]C(=O)C=C

InChI

InChI=1/2C3H4O2.Zn/c2*1-2-3(4)5;/h2*2H,1H2,(H,4,5);/q;;+2/p-2

Property Name	Value
Molecular Formula	C3H4O2.1/2Zn
Molecular Weight	205.96
AlogP	-2.16
Hydrogen Bond Acceptor	4.0
Number of Rotational Bond	2.0
Polar Surface Area	80.26
Heavy Atoms	11.0

Property Name

Value

Molecular Formula

C3H4O2.1/2Zn

Molecular Weight

205.96

AlogP

-2.16

Hydrogen Bond Acceptor

4.0

Number of Rotational Bond

2.0

Polar Surface Area

80.26

Heavy Atoms

11.0

Resources	Reference
CAS NUMBER	14643-87-9
NORMAN SUSDAT
FDA SRS	4720M0PK19

Resources

Reference

CAS NUMBER

14643-87-9

NORMAN SUSDAT

FDA SRS

4720M0PK19

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

ZINC ACRYLATE

Structure

Physicochemical Descriptors

Cross References