Trimethylolpropane
fo-a93c4e437adf6171
Identity
- Type
- Neutral molecule
- CAS
- 77-99-6
- EC
- 201-074-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 across every transformer
Structure
Alternative labels
21- 1,1,1-Tri(hydroxymethyl)propane
- 1,1,1-Trimethylolpropane
- 1,1,1-Tris(hydroxymethyl)propane
- 1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-
- 2,2-Bis(hydroxymethyl)-1-butanol
- 2,2-Bis(hydroxymethyl)butanol
- 2-(Hydroxymethyl)-2-ethyl-1,3-propanediol
- 2-Ethyl-2-(hydroxymethyl)-1,3-propanediol
- 2-ethyl-2-(hydroxymethyl)propane-1,3-diol
- 2-Ethyl-2-(hydroxymethyl)propanediol
- 2-Ethyl-2-hydroxymethyl-1,3-propandiol
- 9U02
- Addolink TR
- Ethriol
- Ethyltrimethylolmethane
- Ettriol
- Propane, 1,1,1-tris(hydroxymethyl)-
- Propylidynetrimethanol
- RC Crosslinker TR
- TMP (alcohol)
- Tris(hydroxymethyl)propane
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | ZJCCRDAZUWHFQH-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H14O3/c1-2-6(3-7,4-8)5-9/h7-9H,2-5H2,1H3 |
| IUPAC name chemrof:IUPAC_name | Trimethylolpropane |
| Molecular formula chemrof:molecular_formula | C6H14O3 |
| Molecular mass chemrof:molecular_mass | 134.175 |
| Monoisotopic mass chemrof:monoisotopic_mass | 134.09429, 134.094294 |
| SMILES string chemrof:smiles_string | CCC(CO)(CO)CO |
Known URLs
17Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=187041-27-6 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=77-99-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:183310 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.000.978 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0366 | enrich_references.pubchem_identifier_url |
| ChemSpider | https://www.chemspider.com/Chemical-Structure.6264.html | enrich_references.chebi_xrefs |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2026448 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=3576 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185136 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/090GDF4HBD | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0259243 | enrich_references.pubchem_identifier_url |
| hts.usitc.gov | https://hts.usitc.gov/search?query=2905.41.00.00 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.936J | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:9D2 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/6510 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q161270 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Trimethylolpropane | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 7d198a80-26f5-47ab-a2f8-e090583f5526 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 1f291d82-6fc4-49e5-a6fc-37f8592b508e | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 9068808c-4f66-4c00-b1ad-23add700581a | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| a1367f55-1fba-4e9e-b3bb-e52a5804c6bb | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 38862eb4-a1a6-4e41-a6d4-6ecb326c961d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| a831611b-d30b-4136-8d77-4823e8fa05e6 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 1f42ba01-b1cd-4f34-8cb2-7c302e94b5ec | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| d4c1218c-0f2c-4f67-9b8c-b5753801d338 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 93cb4df9-9358-4e0d-87eb-da4546b8d3e4 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 3a75dab4-fe02-4753-a15e-c622aca7269a | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 535a6180-5070-4d74-8577-bee1200b8d7e | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| cfaf4484-3794-433b-929d-5535a477afe9 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 6c62366d-8a94-48f0-bb43-488857aba76d | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (59 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works