4-amino-2-hydroxy-n,n,n-trimethyl-4-oxobutan-1-aminium Chloride
fo-947c2b666dae368e
Identity
- Type
- Chemical salt
- CAS
- 5261-99-4
- EC
- 226-073-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
6- (3-Carbamoyl-2-hydroxypropyl)trimethylammonium chloride
- 1-Butanaminium, 4-amino-2-hydroxy-N,N,N-trimethyl-4-oxo-, chloride
- 1-Butanaminium, 4-amino-2-hydroxy-N,N,N-trimethyl-4-oxo-, chloride (1:1)
- 1-Butanaminium, 4-amino-2-hydroxy-N,N,N-trimethyl-4-oxo-, chloride, (±)-
- Ammonium, (3-carbamoyl-2-hydroxypropyl)trimethyl-, chloride, DL-
- DL-Carnitine amide chloride
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | MVOVUKIZAZCBRK-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H16N2O2.ClH/c1-9(2,3)5-6(10)4-7(8)11;/h6,10H,4-5H2,1-3H3,(H-,8,11);1H |
| IUPAC name chemrof:IUPAC_name | (3-Carbamoyl-2-hydroxypropyl)trimethylammonium chloride |
| Molecular formula chemrof:molecular_formula | C7H17ClN2O2 |
| Molecular mass chemrof:molecular_mass | 196.678 |
| Monoisotopic mass chemrof:monoisotopic_mass | 196.097855 |
| SMILES string chemrof:smiles_string | C[N+](C)(C)CC(O)CC(N)=O.[Cl-] |
Known URLs
5Where 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=5261-99-4 | enrich_references.pubchem_identifier_url |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:48601 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID40967042 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/13455332 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27121281 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 307e58ee-8f0c-4489-9b52-13730bf413b8 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 4db98764-ae2b-4259-bb27-449155975341 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| f3b59994-1215-49c7-bc4f-137eeff43317 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 1db8a73f-7f7b-433c-9e9e-2755072c0615 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ed1ef812-bc00-4199-9bc2-d53b101ccf47 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| f7827861-b356-4b8c-a405-4e06d6fcdce5 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 8e7e1e8b-e008-4eba-b8b4-0161dd4189f9 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| d9d8e6ac-1faf-436a-a08d-b590a2e31b04 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| e69327f1-c10c-4e77-959e-2e5e892b29f8 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| da2cd453-c2d0-4067-9d44-80d178765758 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| edbd5556-ea4b-4e59-a3d1-831b559a88a6 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| a4583c63-e7b9-4323-aa5f-dbf5dc799e92 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 0fb3f31a-dde8-45da-9939-3b858a9cf979 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
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