4,4'-methylene-bis-(3-chloro-2,6-diethylaniline)
fo-9467ef430adfbd63
Identity
- Type
- Neutral molecule
- CAS
- 106246-33-7
- EC
- 402-130-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 53 across every transformer
Structure
Alternative labels
15- 2,2′-Dichloro-3,3′,5,5′-tetraethyl-4,4′-diaminodiphenylmethane
- 3,3′,5,5′-Tetraethyl-2,2′-dichloro-4,4′-diaminodiphenylmethane
- 4,4′-Methylenebis(3-chloro-2,6-diethylaniline)
- 4,4′-Methylenebis[3-chloro-2,6-diethylbenzenamine]
- Benzenamine, 4,4′-methylenebis[3-chloro-2,6-diethyl-
- Bis(2-chloro-4-amino-3,5-diethylphenyl)methane
- Bis(4-amino-2-chloro-3,5-diethylphenyl)methane
- C-BS 300
- Lonzacure M-CDEA
- Lonzacure M-CDEA-GS
- M-CDEA
- MCDEA
- Methylenebis(3-chloro-2,6-diethyl-aniline)
- Methylenebis(3-chloro-2,6-diethylaniline)
- Versalink MCDEA
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | VIOMIGLBMQVNLY-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C21H28Cl2N2/c1-5-12-9-14(18(22)16(7-3)20(12)24)11-15-10-13(6-2)21(25)17(8-4)19(15)23/h9-10H,5-8,11,24-25H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | 4,4'-methylene-bis-(3-chloro-2,6-diethylaniline) |
| Molecular formula chemrof:molecular_formula | C21H28Cl2N2 |
| Molecular mass chemrof:molecular_mass | 379.375 |
| Monoisotopic mass chemrof:monoisotopic_mass | 378.162954 |
| SMILES string chemrof:smiles_string | CCc1cc(Cc2cc(CC)c(N)c(CC)c2Cl)c(Cl)c(CC)c1N |
Known URLs
6Where 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=106246-33-7 | enrich_references.consensus_cas_link |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0073031 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/GN49RAR5P2 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J726.035K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/86261 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72444058 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 212aca0c-095e-42e4-a99d-bcba8aa609f4 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 818d3b7e-a594-493a-8180-9f9889545141 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 20c622c2-10de-4ad2-8e4f-cb78948b7e90 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| f1350281-bee3-43bf-91ef-719bbc18e7db | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 2caf42d9-2a2b-4bbe-945e-938be356459a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 00debdc3-d503-4aaf-b383-73116dc53120 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 392aa270-9d26-4c8e-bdc4-2d0318d64b91 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| b52061f3-77a7-4ee7-9692-761e7fae255c | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 93da4ca8-554f-4c47-a81c-b13ef00cbc1f | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 1438e226-2566-456d-ad45-5ac45c50b73a | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 0ad950f3-10f0-4c41-98b5-8ff9a7fe789e | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| d06dfaae-f9e6-424b-a1f3-2732b940edc5 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 77a611f7-dd8f-48e3-9bda-dece3e98f347 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (53 changes)
Full record
Flow object JSON
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"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"402-130-7"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=402-130-7"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}
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