tert-Butyl 3,5-dinitrobenzoate

Modify Date: 2025-09-01 16:58:54

tert-Butyl 3,5-dinitrobenzoate Structure
tert-Butyl 3,5-dinitrobenzoate structure
Common Name tert-Butyl 3,5-dinitrobenzoate
CAS Number 5342-97-2 Molecular Weight 268.22300
Density 1.337 g/cm3 Boiling Point 376.5ºC at 760 mmHg
Molecular Formula C11H12N2O6 Melting Point N/A
MSDS N/A Flash Point 161.3ºC

 Use of tert-Butyl 3,5-dinitrobenzoate


Tert-butyl 3,5-dinitrobenzoate is an intermediate or reactant in organic synthesis and can also play a role in drug synthesis, dye preparation and other chemical fields.The nitro functional group of Tert-butyl 3,5-dinitrobenzoate has certain reactivity in organic chemistry and can participate in various reactions, such as electrophilic substitution, aromatic amine reaction, etc[1].

 Names

Name tert-Butyl 3,5-dinitrobenzoate
Synonym More Synonyms

 tert-Butyl 3,5-dinitrobenzoate Biological Activity

Description Tert-butyl 3,5-dinitrobenzoate is an intermediate or reactant in organic synthesis and can also play a role in drug synthesis, dye preparation and other chemical fields.The nitro functional group of Tert-butyl 3,5-dinitrobenzoate has certain reactivity in organic chemistry and can participate in various reactions, such as electrophilic substitution, aromatic amine reaction, etc[1].
Related Catalog

 Chemical & Physical Properties

Density 1.337 g/cm3
Boiling Point 376.5ºC at 760 mmHg
Molecular Formula C11H12N2O6
Molecular Weight 268.22300
Flash Point 161.3ºC
Exact Mass 268.07000
PSA 117.94000
LogP 3.50470
Index of Refraction 1.561
InChIKey JETCTPYQTQUQPA-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1

 Safety Information

Hazard Codes Xn
Safety Phrases 26-36/37
HS Code 2916399090

 Synthetic Route

~94%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Takimoto, Seiji; Inanaga, Junji; Katsuki, Tsutomu; Yamaguchi, Masaru Bulletin of the Chemical Society of Japan, 1981 , vol. 54, # 5 p. 1470 - 1473

~88%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Takimoto, Seiji; Inanaga, Junji; Katsuki, Tsutomu; Yamaguchi, Masaru Bulletin of the Chemical Society of Japan, 1981 , vol. 54, # 5 p. 1470 - 1473

~%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Altschul Journal of the American Chemical Society, 1948 , vol. 70, p. 2569,2571

~%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Pan, Xusong; Chen, Chao; Peng, Jiang; Yang, Yongan; Wang, Yinghan; Feng, Wen; Deng, Pengchi; Yuan, Lihua Chemical Communications, 2012 , vol. 48, # 76 p. 9510 - 9512

~%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Pan, Xusong; Chen, Chao; Peng, Jiang; Yang, Yongan; Wang, Yinghan; Feng, Wen; Deng, Pengchi; Yuan, Lihua Chemical Communications, 2012 , vol. 48, # 76 p. 9510 - 9512

~%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Reichstein Helvetica Chimica Acta, 1926 , vol. 9, p. 802

~96%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Literature: Dharmaratne, H. R. W.; Gunatilaka, A. A. Leslie; Sotheeswaran, S. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 1 p. 39 - 41

~%

tert-Butyl 3,5-dinitrobenzoate Structure

tert-Butyl 3,5-...

CAS#:5342-97-2

Detail
Literature: White Journal of the American Chemical Society, 1955 , vol. 77, p. 6011,6012 Journal of the American Chemical Society, 1954 , vol. 76, p. 4497

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

t-butyl 3,5-dinitrobenzoate
3,5-dinitro-benzoic acid tert-butyl ester
3.5-Dinitro-benzoesaeure-tert.-butylester
3.5-Dinitro-benzoesaeure-1.1-dimethyl-aethylester
tert.-Butyl-(3.5-dinitro-benzoat)
AB1288
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