EcoDrugPlus


Keyword(s):	Indoor Environment Substances ; Food Contact Chemicals ; Plastic additives
Molecule Category	Free-form
UNII	RK3VCW5Y1L
EPA CompTox	DTXSID6021664

Keyword(s):

Indoor Environment Substances ; Food Contact Chemicals ; Plastic additives

Molecule Category

Free-form

UNII

RK3VCW5Y1L

EPA CompTox

DTXSID6021664


InChI Key	QZZGJDVWLFXDLK-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChI	InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)

InChI Key

QZZGJDVWLFXDLK-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)

Property Name	Value
Molecular Formula	C24H48O2
Molecular Weight	368.37
AlogP	8.67
Hydrogen Bond Acceptor	1.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	22.0
Polar Surface Area	37.3
Heavy Atoms	26.0

Property Name

Value

Molecular Formula

C24H48O2

Molecular Weight

368.37

AlogP

8.67

Hydrogen Bond Acceptor

1.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

22.0

Polar Surface Area

37.3

Heavy Atoms

26.0

Resources	Reference
CAS NUMBER	557-59-5
NORMAN SUSDAT
FDA SRS	RK3VCW5Y1L
PubChem	11197
ChemSpider	10724.0

Resources

Reference

CAS NUMBER

557-59-5

NORMAN SUSDAT

FDA SRS

RK3VCW5Y1L

PubChem

11197

ChemSpider

10724.0

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

TETRACOSANOIC ACID

Structure

Physicochemical Descriptors

Cross References