Styphnic Acid

1,3-Benzenediol, 2,4,6-trinitro-
1,3-Dihydroxy-2,4,6-trinitrobenzene
2,4,6-Trinitro-1,3-benzenediol
2,4,6-Trinitroresorcinol
2,4-Dihydroxy-1,3,5-trinitrobenzene
3-Hydroxy-2,4,6-trinitrophenol
Resorcinol, 2,4,6-trinitro-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	IXHMHWIBCIYOAZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H3N3O8/c10-5-2(7(12)13)1-3(8(14)15)6(11)4(5)9(16)17/h1,10-11H
IUPAC name chemrof:IUPAC_name	Styphnic Acid
Molecular formula chemrof:molecular_formula	C6H3N3O8
Molecular mass chemrof:molecular_mass	245.103
Monoisotopic mass chemrof:monoisotopic_mass	244.992014
SMILES string chemrof:smiles_string	O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1O

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=82-71-3	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.001.306	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7058880	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=36932	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R4TJB1U00D	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.616G	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/6721	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#0219	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q82432	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Styphnic_acid	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
58bc57a2-a13a-4894-bd4b-6befdf014c79	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
8b2c501f-fc63-4c58-8553-a240170defd2	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
0fff832c-1646-4152-840e-e9c5a2516d63	Environmental → Air → Indoor	EF 3.1	kg	2
15f660ef-d78d-410b-9978-0e42be0c609e	Environmental → Air → Long-term	EF 3.1	kg	0
3de7e9db-0a4c-4cb3-8689-076afecca904	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
34a36d8b-05dc-4380-b4f1-a34c0f5954ed	Environmental → Air → Unknown	EF 3.1	kg	2
6bfdbf7d-ea0c-43d9-804c-5e5a874e637b	Environmental → Ground → Agricultural	EF 3.1	kg	2
5986e43a-c107-42bb-91d1-08aebcff186b	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
b50ad04c-0f9b-4375-ba19-ce6a17e7d138	Environmental → Ground → Unknown	EF 3.1	kg	2
64a778a3-e04c-4d27-ad95-c792df27ea83	Environmental → Water → Long-term	EF 3.1	kg	0
03c37d64-389d-4cd7-b332-d462c05c21f0	Environmental → Water → Ocean	EF 3.1	kg	2
4e63a78f-8d74-4182-a6f6-1386835a679f	Environmental → Water → Surface water	EF 3.1	kg	2
73e95e0f-92cc-41d0-9b0e-6ac4004ca6a1	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-534d55ab19ee946e",
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      "@value": "Styphnic Acid",
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}

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Styphnic Acid

Identity

Structure

Alternative labels

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