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Diethyl 5-nitroisophthalate is a chemical compound with a molecular formula of C12H11NO6, featuring a nitro group and two ethyl ester groups attached to an isophthalate backbone. It is typically solid and appears as yellow crystals at room temperature. Recognized for its usage in the synthesis of other complex organic compounds, this compound needs to be handled with caution due to potential reactivity, with exact properties such as the melting point, boiling point, and reactivity detailed in product-specific Material Safety Data Sheets (MSDS).

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  • 10560-13-1 Structure
  • Basic information

    1. Product Name: Diethyl 5-nitroisophthalate
    2. Synonyms: DIETHYL 5-NITROISOPHTHALATE;5-Nitro-1,3-benzenedicarboxylic acid diethyl ester;Einecs 234-144-2
    3. CAS NO:10560-13-1
    4. Molecular Formula: C12H13NO6
    5. Molecular Weight: 267.23
    6. EINECS: 234-144-2
    7. Product Categories: N/A
    8. Mol File: 10560-13-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 384.405 °C at 760 mmHg
    3. Flash Point: 164.049 °C
    4. Appearance: /
    5. Density: 1.272 g/cm3
    6. Vapor Pressure: 1.15E-05mmHg at 25°C
    7. Refractive Index: 1.537
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: Diethyl 5-nitroisophthalate(CAS DataBase Reference)
    11. NIST Chemistry Reference: Diethyl 5-nitroisophthalate(10560-13-1)
    12. EPA Substance Registry System: Diethyl 5-nitroisophthalate(10560-13-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 10560-13-1(Hazardous Substances Data)

10560-13-1 Usage

Uses

Used in Chemical Synthesis:
Diethyl 5-nitroisophthalate is used as a key intermediate in the synthesis of various complex organic compounds, contributing to the development of new materials and products in the chemical industry.
Used in Manufacturing Sector:
Diethyl 5-nitroisophthalate is used as a raw material in the manufacturing of different products, playing a crucial role in the production process and contributing to the final product's properties and performance.
Used in Research and Development:
Diethyl 5-nitroisophthalate is used as a research compound in academic and industrial laboratories, aiding in the exploration of new chemical reactions and the development of innovative applications in various fields.

Check Digit Verification of cas no

The CAS Registry Mumber 10560-13-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,0,5,6 and 0 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 10560-13:
(7*1)+(6*0)+(5*5)+(4*6)+(3*0)+(2*1)+(1*3)=61
61 % 10 = 1
So 10560-13-1 is a valid CAS Registry Number.
InChI:InChI=1/C12H13NO6/c1-3-18-11(14)9-6-5-8(13(16)17)7-10(9)12(15)19-4-2/h5-7H,3-4H2,1-2H3

10560-13-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name Diethyl 5-nitroisophthalate

1.2 Other means of identification

Product number -
Other names 1,3-Benzenedicarboxylic acid, 5-nitro-, diethyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:10560-13-1 SDS

10560-13-1Relevant articles and documents

Design, synthesis, and photochemical behavior of poly(benzyl ester) dendrimers with azobenzene groups throughout their architecture

Wang, Shuangxi,Wang, Ximeng,Li, Lijuan,Advincula, Rigoberto C.

, p. 9073 - 9084 (2004)

A new class of dendrons and dendrimers containing azobenzene units (bearing up to 29 azobenzene groups for four generations) were designed and synthesized with the convergent method, which uses azobenzene derivatives as monomers and benzyl ester groups as linkages leading to photoresponsive dendrons and dendrimers with azobenzene units throughout their architecture. Photochemical isomerization experiments revealed that all of the dendrons and dendrimers undergo trans-cis isomerization by irradiation and cis-trans isomerization by either irradiation or heating.

Design and synthesis of photoresponsive poly(benzyl ester) dendrimers with all-azobenzene repeating units

Wang, Shuangxi,Advincula, Rigoberto C.

, p. 3831 - 3833 (2007/10/03)

equation presented A novel class of dendrons and dendrimers containing all-azobenzene units (up to 29 azobenzene groups) was designed and synthesized by the convergent method using a protected orthogonal AB2 monomer (10) and tetra-functionalized core (11) as building blocks. The preparation of the key monomer (10) involved condensation of a protected nitroso compound (9) and 5-aminoisophthalic acid. These are the first examples of photoresponsive dendrimers with all-azobenzene repeating units.

Process for preparing di-C1 - C4 -alkyl 5-nitro-isophthalates

-

, (2008/06/13)

Particularly pure di-C1 -C4 -alkyl 5-nitro-isophthalates are obtained in good yield and in a simple process by dissolving 5-nitro-isophthalic acid in a mixture of a C1 -C4 -alkyl alcohol and a solvent which is miscible or only partially miscible with water, heating in the presence of a strong acid, thus forming a second, aqueous phase, crystallizing out, after the esterification reaction has ended, the di-C1 -C4 -alkyl 5-nitro-isophthalate formed from the organic phase by cooling and removing the aqueous phase before or after the di-C1 -C4 -alkyl 5-nitro-isophthalate is separated off.

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