4-nitro-o-xylene

1,2-Dimethyl-4-nitrobenzene
3,4-Dimethyl-1-nitrobenzene
4-Nitro-1,2-dimethylbenzene
Benzene, 1,2-dimethyl-4-nitro-
o-Xylene, 4-nitro-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	HFZKOYWDLDYELC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C8H9NO2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3
IUPAC name chemrof:IUPAC_name	4-nitro-o-xylene
Molecular formula chemrof:molecular_formula	C8H9NO2
Molecular mass chemrof:molecular_mass	151.165
Monoisotopic mass chemrof:monoisotopic_mass	151.063329
SMILES string chemrof:smiles_string	Cc1ccc([N+](=O)[O-])cc1C

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=99-51-4	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.002.510	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID2025133	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=66555	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1413373	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FI6475010K	enrich_references.pubchem_identifier_url
hts.usitc.gov	https://hts.usitc.gov/search?query=2904.20.15.00	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J95.095E	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7440	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#1665	enrich_references.pubchem_identifier_url
wikidata.org	https://www.wikidata.org/wiki/Q27277994	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
23880edc-355b-400d-88fd-2361d76d381a	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
61a26ea2-a668-4dde-a553-054024a93b3f	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
24911640-5beb-4022-847c-56e963e75794	Environmental → Air → Indoor	EF 3.1	kg	2
cc712544-de1e-4bb9-8b9c-79b21c934d59	Environmental → Air → Long-term	EF 3.1	kg	0
4e680c5a-65ad-4d83-b241-9bf0a8251ef2	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
616cf898-76ea-4b43-8577-45162c5dcdc9	Environmental → Air → Unknown	EF 3.1	kg	2
ca250a8c-8157-4134-a6d3-f0c2817000ad	Environmental → Ground → Agricultural	EF 3.1	kg	2
5448aa08-90dc-4448-a98d-edf3ebfc6f7f	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
fc7df6f0-0e08-4c3e-8a39-aeab12a81cf8	Environmental → Ground → Unknown	EF 3.1	kg	2
8d456a39-9303-427b-aecb-47d8a6ca088a	Environmental → Water → Long-term	EF 3.1	kg	0
c897ed66-ebd6-42f6-a308-8e9e6e68f9d1	Environmental → Water → Ocean	EF 3.1	kg	2
1f411d64-1ae2-4e29-bcb2-a7e6e557700e	Environmental → Water → Surface water	EF 3.1	kg	2
97ae4856-7607-48c2-9839-96e96715564a	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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4-nitro-o-xylene

Identity

Structure

Alternative labels

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