ethyl 2-nitrohexanoate

Modify Date: 2025-08-26 21:03:06

ethyl 2-nitrohexanoate Structure
ethyl 2-nitrohexanoate structure
Common Name ethyl 2-nitrohexanoate
CAS Number 4447-54-5 Molecular Weight 189.20900
Density 1.067g/cm3 Boiling Point 249.3ºC at 760mmHg
Molecular Formula C8H15NO4 Melting Point N/A
MSDS N/A Flash Point 96ºC

 Names

Name ethyl 2-nitrohexanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.067g/cm3
Boiling Point 249.3ºC at 760mmHg
Molecular Formula C8H15NO4
Molecular Weight 189.20900
Flash Point 96ºC
Exact Mass 189.10000
PSA 72.12000
LogP 1.90820
Index of Refraction 1.441
InChIKey BOMJMFPCSAPKAO-UHFFFAOYSA-N
SMILES CCCCC(C(=O)OCC)[N+](=O)[O-]

 Safety Information

HS Code 2915900090

 Synthetic Route

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Kornblum et al. Journal of the American Chemical Society, 1957 , vol. 79, p. 2507 Full Text View citing articles Show Details Kornblum; Blackwood Org.Synth.Coll.Vol.IV<1963>454,456

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Carmeli, Mira; Rozen, Shlomo Journal of Organic Chemistry, 2006 , vol. 71, # 12 p. 4585 - 4589

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Kornblum et al. Journal of the American Chemical Society, 1955 , vol. 77, p. 6654

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Emmons; Freeman Journal of the American Chemical Society, 1955 , vol. 77, p. 4387,4388 Journal of the American Chemical Society, 1955 , vol. 77, p. 6061,6062

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Stolze, Klaus; Udilova, Natascha; Rosenau, Thomas; Hofinger, Andreas; Nohl, Hans Biochemical Pharmacology, 2005 , vol. 69, # 2 p. 297 - 305

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Feuer,H.; Monter,R.P. Journal of Organic Chemistry, 1969 , vol. 34, # 4 p. 991 - 995

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ethyl 2-nitrohexanoate Structure

ethyl 2-nitrohe...

CAS#:4447-54-5

Literature: Feuer,H.; Monter,R.P. Journal of Organic Chemistry, 1969 , vol. 34, # 4 p. 991 - 995

 Customs

HS Code 2915900090
Summary 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

 Synonyms

2-nitro-hexanoic acid ethyl ester
2-Nitro-hexansaeure-aethylester
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