2-(3-chloropropoxy)-1-methoxy-4-nitrobenzene

1-(2-Methoxy-5-nitrophenoxy)-3-chloropropane
Benzene, 2-(3-chloropropoxy)-1-methoxy-4-nitro-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	JHFBALWBVABSLF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C10H12ClNO4/c1-15-9-4-3-8(12(13)14)7-10(9)16-6-2-5-11/h3-4,7H,2,5-6H2,1H3
IUPAC name chemrof:IUPAC_name	2-(3-chloropropoxy)-1-methoxy-4-nitrobenzene
Molecular formula chemrof:molecular_formula	C10H12ClNO4
Molecular mass chemrof:molecular_mass	245.662
Monoisotopic mass chemrof:monoisotopic_mass	245.045486
SMILES string chemrof:smiles_string	COc1ccc([N+](=O)[O-])cc1OCCCCl

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=92878-95-0	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.127.374	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID00535665	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/JT24UKT3NF	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/13300180	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q72457981	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
22403474-9438-4220-883f-5de8fe57116b	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
67e42d56-e9cd-4e2f-9a52-e86c33a5bef3	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
bd4e7105-832e-4752-8161-c973022dc478	Environmental → Air → Indoor	EF 3.1	kg	2
9f88e335-f754-406b-9e9a-288e7a369842	Environmental → Air → Long-term	EF 3.1	kg	0
b76076d3-76b1-4090-b675-72dd7bf0d83e	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
9f7271e9-0843-4c9e-8908-5b90652ea331	Environmental → Air → Unknown	EF 3.1	kg	2
721c66f2-ade0-45e3-931f-f103b02a2038	Environmental → Ground → Agricultural	EF 3.1	kg	2
a3b52840-0147-494d-9faf-d58edb1f655b	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
060f6548-8bdc-475c-b59f-26897f75a861	Environmental → Ground → Unknown	EF 3.1	kg	2
5230126f-e13c-4adb-a737-6f1a1b0ee72f	Environmental → Water → Long-term	EF 3.1	kg	0
7717c4eb-cc31-42f4-b3cd-9fe55daee9f6	Environmental → Water → Ocean	EF 3.1	kg	2
964f45a1-4929-4fc3-a322-116d11d69a81	Environmental → Water → Surface water	EF 3.1	kg	2
b7029bff-b553-411e-a41a-687f5ac24d89	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (53 changes)

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Flow object JSON

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2-(3-chloropropoxy)-1-methoxy-4-nitrobenzene

Identity

Structure

Alternative labels

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