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529036

3-碘苯甲腈

Name: 3-碘苯甲腈
Brand: ALDRICH

98%

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关于此项目

线性分子式:

IC₆H₄CN

化学文摘社编号:

69113-59-3

分子量:

229.02

NACRES:

NA.22

PubChem Substance ID:

24877638

UNSPSC Code:

12352100

MDL number:

MFCD00079762

Assay:

98%

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属性

Quality Level

100

assay

98%

mp

40-43 °C (lit.)

functional group

iodo, nitrile

SMILES string

Ic1cccc(c1)C#N

InChI

1S/C7H4IN/c8-7-3-1-2-6(4-7)5-9/h1-4H

InChI key

BGARPMGQRREXLN-UHFFFAOYSA-N

说明

General description

3-Iodobenzonitrile is a halogenated aromatic nitrile. Its standard (ρ° = 0.1MPa) molar enthalpy of formation was determined by combustion calorimetry.

Application

3-Iodobenzonitrile may be used as a starting reagent in the synthesis of tetrachloroisophthalo-[¹⁴C]-nitrile (TCIN). It may also be used in the preparation of:

1-(3-iodophenyl)-3-{2-[4-(trifluoromethyl)-1-piperidinyl]ethyl}-2-imidazolidinone
piperidine derivative
chiral amino acid anilide

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)

法规信息

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Synthesis of tetrachloroisophthalo-[¹⁴C]-nitrile.

Davies PE.

Journal of Labelled Compounds & Radiopharmaceuticals, 21(3), 285-292 (1984)

Synthesis of Chiral Amino Acid Anilides by Ligand-Free Copper-Catalyzed Selective N-Arylation of Amino Acid Amides

Dong J, et al.

Advanced Synthesis & Catalysis, 355(4), 692-696 (2013)

Thermodynamic and aromaticity studies for the assessment of the halogen? cyano interactions on Iodobenzonitrile.

Rocha IM, et al.

The Journal of Chemical Thermodynamics, 65, 204-212 (2013)

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全球贸易项目编号

货号	GTIN
529036-1G	04061825771168
529036-10G	04061832107158