2-hydroxy-1-(4-(4-(2-hydroxy-2-methylpropionyl) Benzyl) Phenyl)-2-methylpropan-1-one
fo-f7236110c314cfc2
Identity
- Type
- Neutral molecule
- CAS
- 474510-57-1
- EC
- 444-860-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
5- 1,1′-(Methylene-di-4,1-phenylene)bis[2-hydroxy-2-methyl-1-propanone]
- 1-Propanone, 1,1′-(methylene-di-4,1-phenylene)bis[2-hydroxy-2-methyl-
- 2-Hydroxy-1-[4-[4-(2-hydroxy-2-methyl-propionyl)-benzyl]-phenyl]-2-methyl-1-propan-1-one
- 2-Hydroxy-1-[4-[4-(2-hydroxy-2-methylpropionyl)benzyl]phenyl]-2-methylpropan-1-one
- Bis[4-(2-hydroxy-2-methylpropionyl)phenyl]methane
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | PCKZAVNWRLEHIP-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C21H24O4/c1-20(2,24)18(22)16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)19(23)21(3,4)25/h5-12,24-25H,13H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | 2-hydroxy-1-(4-(4-(2-hydroxy-2-methylpropionyl) Benzyl) Phenyl)-2-methylpropan-1-one |
| Molecular formula chemrof:molecular_formula | C21H24O4 |
| Molecular mass chemrof:molecular_mass | 340.419 |
| Monoisotopic mass chemrof:monoisotopic_mass | 340.167459 |
| SMILES string chemrof:smiles_string | CC(C)(O)C(=O)c1ccc(Cc2ccc(C(=O)C(C)(C)O)cc2)cc1 |
Known URLs
7Where 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=474510-57-1 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.103.987 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID40621591 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/IZJ9BVRDO7 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.065.980E | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/22019754 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72490480 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| f1572a3c-c45f-4306-a57a-3f9fd8422ff9 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 6b81f767-c265-4e75-b2a3-3b4a14e382dd | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 9fbcfadf-a1e8-4137-9b45-d330e4058f42 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| da0b2804-3bb9-4a9d-b155-b6c19c1105fd | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 967f8bb8-d9fb-41d0-9c67-b6e45e4a26bb | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| c75d4f7d-0535-40a0-b65b-9277a5df8355 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 8dc5ed89-655f-4585-b0f9-f1c89f28f293 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 50baf76f-0831-40a7-a1d7-df3e38805b72 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| d5e0d093-8bb1-46de-93f5-06d2110eeb5a | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| d6bdc782-6f46-4e39-b66d-9f64888e2b9d | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 3a5b97bf-79cf-494a-91fa-b9f4095b24c5 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 2e25b15d-0dd7-4f03-a48a-a2487fe3f628 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 9c8291e8-822a-477d-9da8-39844b9824f6 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 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