2-ethylhexyl Nitrate

2-Ethyl-1-hexyl nitrate
2-Ethylhexanol nitrate
Nitric acid, 2-ethylhexyl ester

Property	Value
InChI2D key string chemrof:inchi2d_key_string	NKRVGWFEFKCZAP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C8H17NO3/c1-3-5-6-8(4-2)7-12-9(10)11/h8H,3-7H2,1-2H3
IUPAC name chemrof:IUPAC_name	2-ethylhexyl Nitrate
Molecular formula chemrof:molecular_formula	C8H17NO3
Molecular mass chemrof:molecular_mass	175.228
Monoisotopic mass chemrof:monoisotopic_mass	175.120843
SMILES string chemrof:smiles_string	CCCCC(CC)CO[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=27247-96-7	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.043.952	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.208.096	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID1027928	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL401411	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R11MG529IT	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J154.004A	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/62823	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q26840820	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
57498d5a-05f7-4485-b5e4-93d2dd597a20	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
0a0c0277-6c6d-4f3e-93ed-d5b204b2a685	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
ee1b5352-a98b-48ce-8a68-4f861bcfe12d	Environmental → Air → Indoor	EF 3.1	kg	2
898b4f06-a6ef-4888-b351-7e579bb78c36	Environmental → Air → Long-term	EF 3.1	kg	0
51cbabd8-363c-4803-a9c6-350d85bccad5	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
5e96271c-13ed-49ea-a24b-8d78eeb677dc	Environmental → Air → Unknown	EF 3.1	kg	2
5d81c689-c8b8-4598-8627-035a4591b4c9	Environmental → Ground → Agricultural	EF 3.1	kg	2
dbaf99e1-0101-4eb1-86cc-6e6484e04a75	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
efbfe9d1-c4f3-4ff4-a518-deef92c7c691	Environmental → Ground → Unknown	EF 3.1	kg	2
e9d49f23-6458-4ada-bf64-c51e02fa5456	Environmental → Water → Long-term	EF 3.1	kg	0
203045f5-5732-4c65-adb5-ae6843bec1f9	Environmental → Water → Ocean	EF 3.1	kg	2
091e0fe2-19f2-468d-8b9c-7f030e075cdd	Environmental → Water → Surface water	EF 3.1	kg	2
2a4215b6-0d1f-4974-bb1e-51ffa92c203d	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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2-ethylhexyl Nitrate

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

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