Bisphenol A bis(2-hydroxypropyl) ether
fo-e017edfb77f4a27f
Identity
- Type
- Neutral molecule
- CAS
- 116-37-0
- EC
- 204-137-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
21- 1,1'-[propane-2,2-diylbis(4,1-phenyleneoxy)]dipropan-2-ol
- 1,1′-[(1-Methylethylidene)bis(4,1-phenyleneoxy)]bis[2-propanol]
- 1,1′-[Isopropylidenebis(p-phenyleneoxy)]di-2-propanol
- 1,1′-Isopropylidenebis[4-(2-hydroxypropoxy)benzene]
- 2,2-Bis[4-(2-hydroxy-2-methylethoxy)phenyl]propane
- 2,2-Bis[4-(2-hydroxypropoxy)phenyl]propane
- 2,2-Bis[p-(2-hydroxy-2-methylethoxy)phenyl]propane
- 2,2-Bis[p-(2-hydroxypropoxy)phenyl]propane
- 2,2-Bis[p-(β-hydroxypropoxy)phenyl]propane
- 2-Propanol, 1,1′-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis-
- 2-Propanol, 1,1′-[isopropylidenebis(p-phenyleneoxy)]di-
- BA-P 2
- BA-P 2 Glycol
- Bisphenol A bis(β-hydroxypropyl) ether
- Bisphenol A propoxylate
- Bisphenol A-propylene oxide adduct (1:2)
- Dianol 33
- Himer BP 2P
- Isopropylidenediphenoxypropanol
- Newcol BA-P 2
- Propoxylated bisphenol A 2 mole adduct
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | MIUUNYUUEFHIHM-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C21H28O4/c1-15(22)13-24-19-9-5-17(6-10-19)21(3,4)18-7-11-20(12-8-18)25-14-16(2)23/h5-12,15-16,22-23H,13-14H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | Bisphenol A bis(2-hydroxypropyl) ether |
| Molecular formula chemrof:molecular_formula | C21H28O4 |
| Molecular mass chemrof:molecular_mass | 344.451 |
| Monoisotopic mass chemrof:monoisotopic_mass | 344.198759, 344.19876 |
| SMILES string chemrof:smiles_string | CC(O)COc1ccc(C(C)(C)c2ccc(OCC(C)O)cc2)cc1 |
Known URLs
13Where 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=116-37-0 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=37353-75-6 | enrich_references.pubchem_identifier_url |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:79721 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.003.762 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID8051592 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=408494 | enrich_references.pubchem_identifier_url |
| glycosmos.org | https://glycosmos.org/glycans/show/G73632YE | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/S5K2510L3D | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J39.711C | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C15208 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C15208 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/8306 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27148853 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 5f724917-5e90-4a78-819c-70c52db3828f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| a8418ed5-8e2c-4551-9288-9210f710f592 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| f709dbec-91d6-4f08-a71c-85a20f2d7864 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 7fdc8674-91b3-408b-bfe7-96b1f8cc5e5d | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ca3be4c0-1621-4b8e-98e4-3b13e9c5d535 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 980f360e-3020-4eaf-b414-9e6d4573da75 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 189591c8-b58e-41b0-ad04-c60c0b26189e | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| a5764b48-1206-4a69-961b-9244fd304753 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| ab9b3c52-194e-42d4-88cf-e48a2dd5b627 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| b2b23464-c5e8-4c86-8cb9-0c510866eaf5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 5d1a94b3-8e5d-4d20-bf4b-b92b6809661b | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 64081b68-751f-4239-a209-e12c40a83f11 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| d7ace58d-5a45-4efe-a00d-4f5d1bc397b8 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (57 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