N-[(6-chloropyridin-3-yl)methyl]-2,2-difluoroethanamine
fo-fb5dfce77d884906
Identity
- Type
- Neutral molecule
- CAS
- 1003859-14-0
- EC
- 620-464-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
6- 3-Pyridinemethanamine, 6-chloro-N-(2,2-difluoroethyl)-
- 6-Chloro-N-(2,2-difluoroethyl)-3-pyridinemethanamine
- [(6-Chloropyridin-3-yl)methyl](2,2-difluoroethyl)amine
- N-[(6-Chloro-3-pyridyl)methyl]-2,2-difluoroethanamine
- N-[(6-Chloropyridin-3-yl)methyl]-2,2-difluoroethan-1-amine
- N-[(6-Chloropyridin-3-yl)methyl]-2,2-difluoroethylamine
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | QDQGMLOVCICKPV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H9ClF2N2/c9-7-2-1-6(4-13-7)3-12-5-8(10)11/h1-2,4,8,12H,3,5H2 |
| IUPAC name chemrof:IUPAC_name | N-[(6-chloropyridin-3-yl)methyl]-2,2-difluoroethanamine |
| Molecular formula chemrof:molecular_formula | C8H9ClF2N2 |
| Molecular mass chemrof:molecular_mass | 206.623 |
| Monoisotopic mass chemrof:monoisotopic_mass | 206.042232 |
| SMILES string chemrof:smiles_string | FC(F)CNCc1ccc(Cl)nc1 |
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=1003859-14-0 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.149.283 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID50893606 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/44604123 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q81987703 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 574005ec-9e1c-4d0e-b8fc-7ce7b2acc3ea | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| fc87fab0-f7e3-473e-9cd8-71aa65004393 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 819d9006-2110-4592-afb0-d3472db3a9b8 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 9fcb6abf-cecd-4f76-839c-62164d9ff931 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| b37745f4-4c78-41ce-b3d5-be2b6a96a9bf | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 639c5ba3-fbc1-4ae1-8b69-d087b36e27eb | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 444d52a4-f712-4cef-a73e-28808c2f1b02 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 89bc5359-543e-4ece-8d7e-ab41b4eb5c5a | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 1a630cfd-d92a-4abc-a1a8-144317495153 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 5d4d74b9-6e4d-4a4a-8f67-ffca34ef9efa | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 43bb812c-db26-488b-8744-39b6f5bc2f62 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 5e53b812-253d-4409-8d96-be70be22f930 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 7ad8bdf1-e672-4fa1-a029-7fd84e94f2d0 | 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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- This record is two substances, or it is a second copy of one
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