Consensus flow list

4,4'-methylenebisbenzenamine Dihydrochloride

fo-1728d9aa23ddbc60

Identity

Type
Molecular complex
CAS
13552-44-8
EC
236-934-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 4,4'-methylenebisbenzenamine Dihydrochloride

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string MXNNTNFLRICRPT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C13H14N2.2ClH/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11;;/h1-8H,9,14-15H2;2*1H
IUPAC name chemrof:IUPAC_name 4,4'-methylenebisbenzenamine Dihydrochloride
Molecular formula chemrof:molecular_formula C13H16Cl2N2
Molecular mass chemrof:molecular_mass 271.191
Monoisotopic mass chemrof:monoisotopic_mass 270.069054
SMILES string chemrof:smiles_string Cl.Cl.Nc1ccc(Cc2ccc(N)cc2)cc1

Known URLs

6

Where 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=13552-44-8 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.033.562 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9020871 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/S0V6PBT14R enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/26108 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27288417 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
29068993-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
08a91e70-3ddc-11dd-9adc-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
2ee045ad-0af1-479d-aa9e-80bbddd6b413 Environmental → Air → Indoor EF 3.1 kg 2
08a91e70-3ddc-11dd-9adb-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9add-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
08a91e70-3ddc-11dd-a272-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-a270-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-90d0-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-a271-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-9adf-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-90d1-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
08a91e70-3ddc-11dd-9ade-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
08a91e70-3ddc-11dd-90cf-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-1728d9aa23ddbc60",
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      "@value": "4,4'-methylenebisbenzenamine Dihydrochloride",
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  "altLabel": [
    {
      "@value": "4,4′-Diaminodiphenylmethane dihydrochloride",
      "@language": "en",
      "@lang": "en",
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    {
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    },
    {
      "@value": "Aniline, 4,4′-methylenedi-, dihydrochloride",
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    },
    {
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}

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