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Merck
CN

156272

3,5-Dinitrobenzoyl chloride

≥96.5%, solid

Synonym(s):

DNBC, NSC 2697

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About This Item

Linear Formula:
(O2N)2C6H3COCl
CAS Number:
Molecular Weight:
230.56
NACRES:
NA.21
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
202-750-6
MDL number:
Beilstein/REAXYS Number:
990249
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Product Name

3,5-Dinitrobenzoyl chloride, ≥96.5%

InChI key

NNOHXABAQAGKRZ-UHFFFAOYSA-N

InChI

1S/C7H3ClN2O5/c8-7(11)4-1-5(9(12)13)3-6(2-4)10(14)15/h1-3H

SMILES string

[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(Cl)=O

vapor density

7.6 (vs air)

assay

≥96.5%

form

solid

bp

196 °C/11 mmHg (lit.)

mp

68-69 °C (lit.)

functional group

acyl chloride
nitro

Quality Level

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Application

3,5-Dinitrobenzoyl chloride may be used for the quantitative estimation of hydroxyl groups in pyridine. It may be used in the synthesis of following:
  • 3,5-diamino-N-cyclopropylbenzamide
  • 3,5-dinitro-N-cyclopropylbenzamide
  • 4-(3,5-dinitrophenyl)-6-(dipropan-2-ylamino)-2H-1,3,5-thiadiazine-2-thione4


3,5-Dinitrobenzoyl chloride may also be used as derivatizing agent for the following:

  • biogenic amines present in fermented foods, which can be determined using liquid chromatography method(LC)
  • polyamines, present in biological fluids, which can be determined using high performance liquid chromatography(HPLC)

General description

Crystals of 3,5-dinitrobenzoyl chloride (DNBC) belong to the orthorhombic crystal system and space group Pna21. It is widely used reagent for the detection of alcohols.

pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Regulatory Information

危险化学品
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Synthesis and characterization of aromatic poly (amides) based on 3, 5-diamino-N-cyclopropylbenzamide.
Tundidor-Camba A, et al.
Royal Society of Chemistry Advances, 5(29), 23057-23066 (2015)
Rapid Determination of Organic Hydroxyl Groups with 3, 5,-Dinitrobenzoyl Chloride.
Robinson Jr WT, et al.
Analytical Chemistry, 33(8), 1030-1034 (1961)
A Markowska et al.
Roczniki Akademii Medycznej w Bialymstoku (1995), 42(1), 129-140 (1997-01-01)
A carbocyclic analogue of distamycin was obtained, in which the N-methylpyrrole rings were substituted by disubstituted benzene rings. Additionally, N-chloro- or N-bromoacetyl groups, displaying alkylating properties, were introduced. The synthesis, starting from 3,5-dinitrobenzoyl chloride, consisted of five stages.
3, 5-Dinitrobenzoyl chloride.
Wang HY, et al.
Acta Crystallographica Section E, Structure Reports Online, 65(10), o2460-o2460 (2009)
Jiu-gao Yu et al.
Yao xue xue bao = Acta pharmaceutica Sinica, 38(3), 191-195 (2003-07-02)
To prepare a novel creatinine adsorbent with anti-renal failure activity. A novel starch ester was prepared under heterogeneous condition by the reaction of starch (ST) and 3, 5-dinitrobenzoyl chloride (DNBZ-Cl). The products were characterized by means of elemental analysis, FTIR

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