Consensus flow list

3,6-diamino-10-methylacridinium Chloride

fo-213131b1f9da85a6

Identity

Type
Chemical salt
CAS
86-40-8
EC
201-668-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for 3,6-diamino-10-methylacridinium Chloride

Alternative labels

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string KKAJSJJFBSOMGS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H13N3.ClH/c1-17-13-7-11(15)4-2-9(13)6-10-3-5-12(16)8-14(10)17;/h2-8H,1H3,(H3,15,16);1H
IUPAC name chemrof:IUPAC_name 3,6-diamino-10-methylacridinium Chloride
Molecular formula chemrof:molecular_formula C14H14ClN3, C14H14N3.Cl
Molecular mass chemrof:molecular_mass 259.74
Monoisotopic mass chemrof:monoisotopic_mass 259.087625, 259.08763
SMILES string chemrof:smiles_string C[n+]1c2cc(N)ccc2cc2ccc(N)cc21.[Cl-]

Known URLs

14

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=86-40-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:383703 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.517 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID60273975 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2755 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=47700 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=757387 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL354349 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1TW3Q60E36 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C77087 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6842 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/6737429 enrich_references.chebi_xrefs
reaxys reaxys:3579028 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q81977399 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e392531e-1554-4c1c-8655-6c87a692bfda Environmental → Air → Aircraft cruise height EF 3.1 kg 2
e2c97b4d-94f0-48c9-be9d-d9fdd3856d76 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
b6bd09e2-71c3-457c-ac41-f7500844711a Environmental → Air → Indoor EF 3.1 kg 2
30beb23a-ce1e-4008-a8e0-7134dc96dcaf Environmental → Air → Long-term EF 3.1 kg 0
0c3200a3-8441-42a0-a51f-2556d1f2d8ce Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
fb3e714d-04c7-44ed-992b-4184905b8a05 Environmental → Air → Unknown EF 3.1 kg 2
68270f20-1935-45d1-8165-4ec3417e7697 Environmental → Ground → Agricultural EF 3.1 kg 2
4a6f0d71-b6e7-42eb-bae6-ea9eb53e2106 Environmental → Ground → Non-agricultural EF 3.1 kg 2
f3fe184e-bdbe-40cc-aa63-5a35244e8eb2 Environmental → Ground → Unknown EF 3.1 kg 2
3dbc949f-11d6-4eae-b41c-4b9892f399d9 Environmental → Water → Long-term EF 3.1 kg 0
ade0d31b-ef08-4619-b045-f68a82e1143e Environmental → Water → Ocean EF 3.1 kg 2
c76e7fc0-2e62-46db-a217-b8011fdb8009 Environmental → Water → Surface water EF 3.1 kg 2
16d2dbb0-0fbd-4d81-b60d-81a5f907f8fa Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
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