Dinitramine

1,3-Benzenediamine, N1,N1-diethyl-2,6-dinitro-4-(trifluoromethyl)-
Cobex
Cobex (herbicide)
Kobex
N1,N1-Diethyl-2,6-dinitro-4-(trifluoromethyl)-1,3-benzenediamine
N3,N3-Diethyl-2,4-dinitro-6-(trifluoromethyl)-1,3-phenylenediamine
N3,N3-Diethyl-2,4-dinitro-6-(trifluoromethyl)-m-phenylenediamine
Toluene-2,4-diamine, N4,N4-diethyl-α,α,α-trifluoro-3,5-dinitro-

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	OFDYMSKSGFSLLM-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C11H13F3N4O4/c1-3-16(4-2)9-7(17(19)20)5-6(11(12,13)14)8(15)10(9)18(21)22/h5H,3-4,15H2,1-2H3
IUPAC name chemrof:IUPAC_name	1,3-Benzenediamine, N1,N1-diethyl-2,6-dinitro-4-(trifluoromethyl)-
Molecular formula chemrof:molecular_formula	C11H13F3N4O4
Molecular mass chemrof:molecular_mass	322.243
Monoisotopic mass chemrof:monoisotopic_mass	322.08889
SMILES string chemrof:smiles_string	CCN(CC)c1c([N+](=O)[O-])cc(C(F)(F)F)c(N)c1[N+](=O)[O-]

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=29091-05-2	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81959	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.044.912	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID9040265	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1223066	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/XHQ6D15979	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J20.297E	enrich_references.pubchem_identifier_url
KEGG	https://www.genome.jp/entry/C18785	enrich_references.chebi_xrefs
kegg.jp	https://www.kegg.jp/entry/C18785	enrich_references.pubchem_identifier_url
ppdb	ppdb:248	enrich_references.chebi_xrefs
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/34468	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=500972	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q27155666	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
ab7d95b3-6103-4269-b0a8-fdea257d21a0	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
b6830f44-0dbb-46fb-9afb-dda1810fab26	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
13d5a11b-dfc8-4d7a-8971-da735af76a48	Environmental → Air → Indoor	EF 3.1	kg	2
fc23e432-70ca-4d77-9d57-3742251b273a	Environmental → Air → Long-term	EF 3.1	kg	0
018e7ae7-543d-4101-bb28-790f7655a531	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
984ed72a-1b6d-4918-aea9-fd14562b7dcd	Environmental → Air → Unknown	EF 3.1	kg	2
2c0dcd00-c1fb-4082-9a65-6754f095c1d6	Environmental → Ground → Agricultural	EF 3.1	kg	2
ac11b801-5ba7-4e2c-b907-58e9e1ba5ba0	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
028ca3484b4ed80d9a468513b43f2a4b64929a70	Environmental → Ground → Silvicultural	ecoinvent algorithm addition	kg	0
4d6a266e-84e1-4c5c-9b7e-304f7803c902	Environmental → Ground → Unknown	EF 3.1	kg	2
bc5fab2f-571e-4cea-aacd-2bf510cef911	Environmental → Water → Long-term	EF 3.1	kg	0
0daec946-4541-4331-930f-a651a867013e	Environmental → Water → Ocean	EF 3.1	kg	2
d84cd3ee-b638-4212-8711-58cc9d90320c	Environmental → Water → Surface water	EF 3.1	kg	2
6fed40c2-6c86-47d5-a843-b58587cfbd5a	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Dinitramine

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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