Consensus flow list

2-[(4-n,n-bis-(2'-hydroxyethyl)amino-2-nitrophenyl)amino]ethanol

fo-cddd6272d6b42465

Identity

Type
Neutral molecule
CAS
33229-34-4
EC
251-410-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2-[(4-n,n-bis-(2'-hydroxyethyl)amino-2-nitrophenyl)amino]ethanol

Alternative labels

16

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string MIWUTEVJIISHCP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H19N3O5/c16-6-3-13-11-2-1-10(9-12(11)15(19)20)14(4-7-17)5-8-18/h1-2,9,13,16-18H,3-8H2
IUPAC name chemrof:IUPAC_name 2,2'-[[4-[(2-Hydroxyethyl)amino]-3-nitrophenyl]imino]bis-ethanol
Molecular formula chemrof:molecular_formula C12H19N3O5
Molecular mass chemrof:molecular_mass 285.3
Monoisotopic mass chemrof:monoisotopic_mass 285.13247, 285.132471
SMILES string chemrof:smiles_string O=[N+]([O-])c1cc(N(CCO)CCO)ccc1NCCO

Known URLs

11

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=33229-34-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82472 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.046.722 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6020193 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1561876 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6C0EL1931V enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J78.133I enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19429 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19429 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/36383 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27155970 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
970529a2-1d3c-43ae-b359-6d4a3c89d140 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
62aa861b-9044-4737-a3ad-a4dfe4d5de80 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
6d4d1f49-457c-4bd0-bcdf-1ce3dd512f06 Environmental → Air → Indoor EF 3.1 kg 4
4c42d495-27f2-4335-a242-5e8e8f15a55f Environmental → Air → Long-term EF 3.1 kg 0
d3780fc2-1961-4a9d-9f5d-7a209889a3e1 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
57b1d511-710a-46d0-bc1c-c917029db78f Environmental → Air → Unknown EF 3.1 kg 4
1e87b5b2-2b42-48a8-96df-b34c8a31f228 Environmental → Ground → Agricultural EF 3.1 kg 4
b18d3d06-b1f1-4409-ae9c-0a61283fb165 Environmental → Ground → Non-agricultural EF 3.1 kg 4
867621fc-d343-4eb3-9e37-a8b68673b947 Environmental → Ground → Unknown EF 3.1 kg 4
aa64d90d-3f1a-45c2-8634-ea2ef80e0ea2 Environmental → Water → Long-term EF 3.1 kg 0
8b9eaeb7-1102-41d5-85eb-e83f64a6eada Environmental → Water → Ocean EF 3.1 kg 4
a8d45e4d-ff2f-435d-8672-6081f41aeee7 Environmental → Water → Surface water EF 3.1 kg 4
22f11fb4-942e-474a-8fd4-6140b5aee3ad Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
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