N,n-diethylpropane-1,3-diamine
fo-7e69ed0e05a16aea
Identity
- Type
- Neutral molecule
- CAS
- 104-78-9
- EC
- 203-236-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
26- (3-Diethylaminopropan-1-yl)amine
- 1,1-Diethyl-1,5-diazapentane
- 1,3-Propanediamine, N,N-diethyl-
- 1,3-Propanediamine, N1,N1-diethyl-
- 1-Amino-3-(diethylamino)propane
- 3-(Diethylamino)-n-propylamine
- 3-(Diethylamino)propanamine
- 3-(Diethylamino)propylamine
- 3-(N,N-Diethylamino)-1-propylamine
- 3-(N,N-Diethylamino)propylamine
- 3-Diethylamino-1-propaneamine
- 3-Diethylamino-1-propylamine
- Diethylaminotrimethylenamine
- N,N-Diethyl-1,3-diaminopropane
- N,N-Diethyl-1,3-propanediamine
- N,N-Diethyl-1,3-propylenediamine
- N,N-Diethyltrimethylenediamine
- N,N-Ethylpropane-1,3-diamine
- N-(3-Aminopropyl)-N,N-diethylamine
- N-(3-Aminopropyl)diethylamine
- N-(3-Diethylaminopropyl)amine
- N-(Diethylaminopropyl)amine
- N-Aminopropyl-N,N-diethylamine
- N1,N1-Diethyl-1,3-propanediamine
- N1,N1-Diethylpropane-1,3-diamine
- γ-(Diethylamino)propylamine
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | QOHMWDJIBGVPIF-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H18N2/c1-3-9(4-2)7-5-6-8/h3-8H2,1-2H3 |
| IUPAC name chemrof:IUPAC_name | (3-Diethylaminopropan-1-yl)amine |
| Molecular formula chemrof:molecular_formula | C7H18N2 |
| Molecular mass chemrof:molecular_mass | 130.235 |
| Monoisotopic mass chemrof:monoisotopic_mass | 130.146999 |
| SMILES string chemrof:smiles_string | CCN(CC)CCCN |
Known URLs
9Where 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=104-78-9 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.943 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID7059303 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7776 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/JB92D3RAVH | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.461I | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/61011 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#2684 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q27281417 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| e861f7a1-2160-4d4e-a2a6-eb54323cc49b | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 997ca26f-71d4-471c-ae33-3f9533150f4e | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 8d566cfe-ce37-4dd4-a2ce-ce6bdee2bd5c | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 918063a9-d1f6-4e55-bb7a-eebfbc210535 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 3899e04c-59a3-4e07-b50b-633775f15987 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| b71050c1-0767-4cac-b7e5-509ba22bfb4f | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 93146c2f-e3fc-4a32-aad3-f01ffcd660d6 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| c13f3923-1af9-4910-a5ef-3a97c4e340a2 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| a408d1a3-98a9-4085-9c79-82bb1813741b | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 064f8677-234a-4591-8c85-9e62ece14891 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 165297fa-f211-4464-b18c-7e2e86119d8c | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 848134ed-f310-4656-b063-846c78ddfc02 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| e4db9813-8f88-49e1-92dd-555f7d84e21e | 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