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S17_KEMIMARKET

S17 | KEMIMARKET | KEMI Market List

List of chemicals on the market from the Swedish Chemicals Agency (KEMI). Provided by Stellan Fischer, KEMI including Hazard and Exposure scores, documented here. Curated by Reza Aalizadeh, University of Athens and Emma Schymanski, UniLu. Dataset DOI: 10.5281/zenodo.2628786.

Nov 14 2019 update: added CSV of latest file. Nov 21 Update: fixed 3 truncated InChIKeys in CSV and InChIKey file. Feb 6, 2020: fixed SMILES issues in CSV for PubChem import. Jul 24, 2020: fixed two synonyms based on feedback from PubChem for GFMHHNOUDDHEOO-UHFFFAOYSA-N and LAUVMIDRJMQUQL-UHFFFAOYSA-N. 17 July 2022: fixed several SMILES errors in CSV, updated IK file for PubChem deposition. 18 July 2022: fixed truncated SMILES that failed PubChem standardization (LCTORFDMHNKUSG-GJHKVECASA-N). 18 Jun 2023: fixed two SMILES that failed PubChem deposition for ILENATNBFPBMHG-UHFFFAOYSA-N and NOESYZHRGYRDHS-ZYCCASTOSA-N, plus one that failed standardization (JBEHRBTVEGZLAF-UHFFFAOYSA-N).

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Rows: 50308 Columns: 6 Citations: 0 Downloads: 3633
S35_INDOORCT16

S35 | INDOORCT16 | Indoor Environment Substances from 2016 Collaborative Trial

Merged files from the NORMAN Indoor Dust Collaborative Trial, 2016 provided by Peter Haglund (UMU) and Pawel Rostkowski (NILU). Details in Rostkowski et al. 2019 DOI: 10.1007/s00216-019-01615-6. Dataset DOI: 10.5281/zenodo.2653206.

Update 6 Feb 2020: two NA SMILES removed in CSV for PubChem upload. 17/7/2022: NA and N/A SMILES removed from CSV and XLSX, most replaced with structures; some are representative structures for classes.

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Rows: 2056 Columns: 6 Citations: 2 Downloads: 1683
S52_THSMOKE

S52 | THSMOKE | Thirdhand Smoke (THS) Compounds

Thirdhand Smoke (THS, the tobacco-related gases and particles that become embedded in materials) suspect list compiled by Sonia Torres and Noelia Ramirez (IISPV-URV) and Emma Schymanski (LCSB). Presentation available here: DOI: 10.5281/zenodo.3613471. Dataset DOI: 10.5281/zenodo.2669466.

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Rows: 95 Columns: 20 Citations: 0 Downloads: 1097
S101_MTMDUST

S101 | MTMDUST | List of chemicals characterised in indoor dust samples

A list of 300 chemicals characterised with identification confidence level >= 3 found in retrospective analysis of 30 dust samples from 4 different indoor settings described in Dubocq et al. (2022) DOI: 10.20517/jeea.2022.23. Dataset DOI: 10.5281/zenodo.7327062.

A list of 300 chemicals characterised with identification confidence level of ≥3 found in retrospective analysis of 30 dust samples from 4 different indoor settings (offices, households, preschools and various occupational settings) described in Dubocq et al. (2022) DOI: 10.20517/jeea.2022.23 which can help to better estimate the exposure risks of organic contaminants to humans in the indoor environment. The categories of the main detected chemical groups were plant natural products (n = 57), personal care products (n = 44), pharmaceuticals (n = 44), food additives (n = 43), plasticisers (n = 43), flame retardants (n = 43), colourants (n = 42) and pesticides (n = 31).

Additional notes: For entries existing in multiple isomeric forms, an additional row has been added (ID347-352) with corresponding identifiers while the metadata for each isomer exist as per original entries.
 

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Rows: 352 Columns: 42 Citations: 1 Downloads: 567
S108_SINLIST

S108 | SINLIST | SIN (Substitute It Now) list of hazardous chemicals by ChemSec

SIN (Substitute It Now) list of hazardous chemicals used in a wide variety of articles, products and manufacturing processes around the globe. The SIN List consists of chemicals that have been identified by the non-profit ChemSec (https://sinlist.chemsec.org/) as being Substances of Very High Concern, based on the criteria defined within REACH, the EU chemicals legislation. The SIN abbreviation implies that these chemicals should be removed as soon as possible as they pose a threat to human health and the environment. List provided by Anna Lennquist (ChemSec, SE) and Hans Peter Arp (NGI/NTNU, NO). Dataset DOI: 10.5281/zenodo.8109043.

List updated with new substances on 08 May 2024.

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Rows: 1423 Columns: 29 Citations: 0 Downloads: 718
S120_DUSTCT2024

S120 | DUSTCT2024 | Substances from Second NORMAN Collaborative Dust Trial

List of substances detected via GC-MS and LC-MS from the second NORMAN collaborative dust trial initiated in 2020, including classification and detection information as described in Haglund et al (2024) DOI: 10.1016/j.scitotenv.2024.177639. Dataset DOI: 10.5281/zenodo.13835254.

 

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Rows: 1210 Columns: 12 Citations: 1 Downloads: 1293