1,1'-[(3-aminopropyl)imino]diethanol
fo-e42d7751a60398c8
Identity
- Type
- Neutral molecule
- CAS
- 4985-85-7
- EC
- 225-642-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
21- (3-Aminopropyl)bis(2-hydroxyethyl)amine
- (3-Aminopropyl)diethanolamine
- 2,2′-[(3-aminopropyl)azanediyl]bis(ethanol)
- 2,2′-[(3-Aminopropyl)imino]bis[ethanol]
- 2,2′-[(3-Aminopropyl)imino]diethanol
- 2-[(3-Aminopropyl)(2-hydroxyethyl)amino]ethan-1-ol
- 2-[(3-Aminopropyl)(2-hydroxyethyl)amino]ethanol
- 3-[Bis(2-hydroxyethyl)amino]propylamine
- 3-[N,N-(Diethanol)amino]propylamine
- [3-(Diethanolamino)propyl]amine
- Ethanol, 2,2′-[(3-aminopropyl)imino]bis-
- Ethanol, 2,2′-[(3-aminopropyl)imino]di-
- N,N-Bis(2-hydroxyethyl)-1,3-diaminopropane
- N,N-Bis(2-hydroxyethyl)-1,3-propanediamine
- N,N-Bis(2-hydroxyethyl)-3-aminopropylamine
- N,N-Di(2-hydroxyethyl)-1,3-propanediamine
- N-(3-Aminopropyl)-3-azapentane-1,5-diol
- N-(3-Aminopropyl)-N,N-bis(2-hydroxyethyl)amine
- N-(3-Aminopropyl)-N,N-diethanolamine.
- N-(3-Aminopropyl)diethanolamine
- N-3-Aminopropyl-N,N-di(2-hydroxyethyl)amine
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | FKJVYOFPTRGCSP-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H18N2O2/c8-2-1-3-9(4-6-10)5-7-11/h10-11H,1-8H2 |
| IUPAC name chemrof:IUPAC_name | (3-Aminopropyl)bis(2-hydroxyethyl)amine |
| Molecular formula chemrof:molecular_formula | C7H18N2O2 |
| Molecular mass chemrof:molecular_mass | 162.233 |
| Monoisotopic mass chemrof:monoisotopic_mass | 162.136828 |
| SMILES string chemrof:smiles_string | NCCCN(CCO)CCO |
Known URLs
10Where 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=4985-85-7 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.023.311 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2044680 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8172 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186851 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R21ZI8N14B | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.795G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/21088 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#3267 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q27287690 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| eb0c5f19-4afc-4782-93d9-ddcd1f453443 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| b6f9d28e-80d2-4f8a-9ec1-1ffe30245108 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 97c420e9-4ff8-4a2a-9357-b4d12a741160 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| ab83d062-29f8-4e4f-b95c-9c10f62fe160 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 9bb0c6d7-4e81-4e4e-9703-8cc360bbd26c | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| d95f85c8-a066-4382-98b9-1e1bed0ed9f4 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 2b50ac90-1219-4688-acc9-dd8aa7cd2c52 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| f88b099e-d657-4966-b5f8-3ee5ab124309 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 91cea046-882b-4912-8c3d-99c210c24802 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 24024dd2-95fd-4fd8-93a7-e645174af30c | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 6690c032-d01e-4131-9aa3-3d75d1303efc | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| e65c0fe0-d1c8-449b-94cc-6da59498a89e | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 9f7b9544-2468-4af4-a2c9-1fdcec61ff67 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (54 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