Consensus flow list

4h-3,1-benzoxazine-2,4(1h)-dione

fo-9a470dcfae35f26c

Identity

Type
NeutralMolecule
CAS
118-48-9
EC
204-255-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
63 across every transformer

Structure

Structure diagram for 4h-3,1-benzoxazine-2,4(1h)-dione

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string TXJUTRJFNRYTHH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H5NO3/c10-7-5-3-1-2-4-6(5)9-8(11)12-7/h1-4H,(H,9,11)
IUPAC name chemrof:IUPAC_name 4h-3,1-benzoxazine-2,4(1h)-dione, 4H-3,1-benzoxazine-2,4(1H)-dione
Molecular formula chemrof:molecular_formula C8H5NO3
Molecular mass chemrof:molecular_mass 163.132
Monoisotopic mass chemrof:monoisotopic_mass 163.026943
SMILES string chemrof:smiles_string O=c1[nH]c2ccccc2c(=O)o1

Known URLs

15

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=118-48-9 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.869 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6026955 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB11593 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=104662 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=29555 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL346059 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R8TFA74Y4U enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.526C enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=152737 enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL346059 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8359 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=189632 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q11286492 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Isatoic_anhydride enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
004ed126-6917-436b-9f74-215bdd1eb9f1 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
2a6f6fa3-923e-4099-81fc-2f845be9f60d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
ec4c7d03-2493-4401-a37c-fb14cc102806 Environmental → Air → Indoor EF 3.1 kg 2
5b10ac4d-96ab-4417-9c93-c9ea712e039e Environmental → Air → Long-term EF 3.1 kg 0
76b657ba-476a-432b-9597-21c2cf5893b9 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b877cfcf-84e0-4582-a685-1d9ca8062c47 Environmental → Air → Unknown EF 3.1 kg 2
9816d895-02c2-41e1-bc6a-293407e498ff Environmental → Ground → Agricultural EF 3.1 kg 2
7d9da701-591f-4ea4-9462-6284be0c40b3 Environmental → Ground → Non-agricultural EF 3.1 kg 2
2feee134-1677-462d-a53b-f3fc0b4361a2 Environmental → Ground → Unknown EF 3.1 kg 2
9f803b57-7a69-43e8-9a36-e1cab866db27 Environmental → Water → Long-term EF 3.1 kg 0
dacc0b13-371e-453c-904c-de015cf6b451 Environmental → Water → Ocean EF 3.1 kg 2
dd18860f-7efb-4781-b000-d086b1b95394 Environmental → Water → Surface water EF 3.1 kg 2
dc4a35e2-0833-4aad-aab9-65402c1b4b8a Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (63 changes)

Open the changes page

Full record

Flow object JSON 
{
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