Benzeneacetic acid,2,4-dinitro-, methyl ester

Modify Date: 2024-01-10 17:40:22

Benzeneacetic acid,2,4-dinitro-, methyl ester Structure
Benzeneacetic acid,2,4-dinitro-, methyl ester structure
Common Name Benzeneacetic acid,2,4-dinitro-, methyl ester
CAS Number 58605-12-2 Molecular Weight 240.17000
Density 1.447g/cm3 Boiling Point 362ºC at 760mmHg
Molecular Formula C9H8N2O6 Melting Point N/A
MSDS N/A Flash Point 168.5ºC

 Names

Name methyl 2-(2,4-dinitrophenyl)acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.447g/cm3
Boiling Point 362ºC at 760mmHg
Molecular Formula C9H8N2O6
Molecular Weight 240.17000
Flash Point 168.5ºC
Exact Mass 240.03800
PSA 117.94000
LogP 2.26490
Index of Refraction 1.581
InChIKey HTANURMJHZJJSO-UHFFFAOYSA-N
SMILES COC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
Storage condition 2-8℃

 Synthetic Route

~99%

Benzeneacetic acid,2,4-dinitro-, methyl ester Structure

Benzeneacetic a...

CAS#:58605-12-2

Literature: Schering AG Patent: US2004/39019 A1, 2004 ; Location in patent: Page/Page column 5-6 ; US 20040039019 A1

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Benzeneacetic acid,2,4-dinitro-, methyl ester Structure

Benzeneacetic a...

CAS#:58605-12-2

Literature: Chemische Berichte, , vol. 42, p. 1317 Chemische Berichte, , vol. 21, p. 1307

~46%

Benzeneacetic acid,2,4-dinitro-, methyl ester Structure

Benzeneacetic a...

CAS#:58605-12-2

Literature: Maruoka, Hiroshi; Tomioka, Yukihiko Journal of Heterocyclic Chemistry, 2003 , vol. 40, # 6 p. 1051 - 1057

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Benzeneacetic acid,2,4-dinitro-, methyl ester Structure

Benzeneacetic a...

CAS#:58605-12-2

Literature: Synthesis, , # 3 p. 242 - 243

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Benzeneacetic acid,2,4-dinitro-, methyl ester Structure

Benzeneacetic a...

CAS#:58605-12-2

Literature: Synthesis, , # 3 p. 242 - 243

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Benzeneacetic acid,2,4-dinitro-, methyl ester Structure

Benzeneacetic a...

CAS#:58605-12-2

Literature: Farmaco (1946-1952), , vol. 3, p. 509,523

 Synonyms

Methyl 2,4-dinitrophenylacetate
BEN173
2.4-Dinitro-phenylessigsaeure-methylester
methyl 2,4-dinitrobenzeneacetate
(2,4-dinitrophenyl)-acetic acid methyl ester
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