Consensus flow list

2-[(1-amino-4-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)oxy]ethyl Phenyl Carbonate

fo-b0d3c142c5c655af

Identity

Type
Neutral molecule
CAS
28173-59-3
EC
248-882-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2-[(1-amino-4-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)oxy]ethyl Phenyl Carbonate

Alternative labels

3

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GLLYQJVICPAIGW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C23H17NO7/c24-20-17(29-10-11-30-23(28)31-13-6-2-1-3-7-13)12-16(25)18-19(20)22(27)15-9-5-4-8-14(15)21(18)26/h1-9,12,25H,10-11,24H2
IUPAC name chemrof:IUPAC_name 2-[(1-amino-4-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)oxy]ethyl Phenyl Carbonate
Molecular formula chemrof:molecular_formula C23H17NO7
Molecular mass chemrof:molecular_mass 419.389
Monoisotopic mass chemrof:monoisotopic_mass 419.100502
SMILES string chemrof:smiles_string Nc1c(OCCOC(=O)Oc2ccccc2)cc(O)c2c1C(=O)c1ccccc1C2=O

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=28173-59-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.044.424 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8067361 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J32.706I enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/119885 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q81993944 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f9335d61-00ee-46f0-8727-81fc8a777fee Environmental → Air → Aircraft cruise height EF 3.1 kg 2
3c55fd6c-4da3-45fb-adb3-015d02a7b02e Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
48f87918-9ef6-4dfa-a948-8930d32180e6 Environmental → Air → Indoor EF 3.1 kg 2
7efebf9f-f4f7-4565-9672-dcefc26f6b5f Environmental → Air → Long-term EF 3.1 kg 0
785c47b7-825e-4dd3-a62b-29b89e6a510a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9963a029-ca75-4d7d-9dd5-0953bccfaed5 Environmental → Air → Unknown EF 3.1 kg 2
d0c594d4-1858-4d07-851a-ba4fe4f49017 Environmental → Ground → Agricultural EF 3.1 kg 2
7968a66e-3413-4acf-851d-2519c2f09d1d Environmental → Ground → Non-agricultural EF 3.1 kg 2
c502bc8b-0af6-4062-886d-e3dc243ce80b Environmental → Ground → Unknown EF 3.1 kg 2
fd88e1da-d2b3-4224-868e-3c878ebeec74 Environmental → Water → Long-term EF 3.1 kg 0
f7d5e5d7-2313-431b-b050-90d04befcd52 Environmental → Water → Ocean EF 3.1 kg 2
572ab49e-339c-4a9a-b80f-d302c7de9b10 Environmental → Water → Surface water EF 3.1 kg 2
34e4289d-0a4c-43c5-9ba6-7bea81c5d283 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-b0d3c142c5c655af",
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    {
      "@value": "2-[(1-amino-4-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)oxy]ethyl Phenyl Carbonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-[(1-Amino-9,10-dihydro-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]ethyl phenyl carbonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Carbonic acid, 2-[(1-amino-9,10-dihydro-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]ethyl phenyl ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Carbonic acid, phenyl ester, 2-ester with 1-amino-4-hydroxy-2-(2-hydroxyethoxy)anthraquinone",
      "@language": "en",
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}

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