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1466-88-2

Basic Information
CAS No.: 1466-88-2
Name: 2-NITROCINNAMALDEHYDE
Article Data: 52
Molecular Structure:
Molecular Structure of 1466-88-2 (2-NITROCINNAMALDEHYDE)
Formula: C9H7NO3
Molecular Weight: 177.159
Synonyms: Cinnamaldehyde,o-nitro- (6CI,7CI,8CI);2-Nitrocinnamaldehyde;2-Nitrocinnamic aldehyde;3-(2-Nitrophenyl)-2-propenal;3-(2-Nitrophenyl)propenal;NSC 28458;o-Nitrocinnamaldehyde;
EINECS: 215-988-0
Density: 1.269g/cm3
Melting Point: 127-129 °C(lit.)
Boiling Point: 348.1 °C at 760 mmHg
Flash Point: 178.1 °C
Solubility: Soluble in methanol. Insoluble in water.
Appearance: light yellow to yellow-brown crystals or powder
Hazard Symbols: IrritantXi
Risk Codes: 36/38
Safety: 26-36
PSA: 62.89000
LogP: 2.33010
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  • Shanghai PotentPharm Science and Technology Co.,Ltd

     China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:86-021-51969655

    Address:Unit B, Building 18, No.300, Chuantu Rd,Pudong District, Shanghai 201202, China

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  • 2-Nitrocinnamaldehyde

  • Casno:

    1466-88-2

    2-Nitrocinnamaldehyde

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four yearsOur key scientific leadership team has gained experience in top research and developmen

    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four years Our key scienti

  • Debye Scientific

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+85221376140

    Address:Rm. 19C, Lockhart Ctr., 301-307 Lockhart Rd., Wan Chai

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  • 3-(2-Nitrophenyl)acrylaldehyde

  • Casno:

    1466-88-2

    3-(2-Nitrophenyl)acrylaldehyde

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    High quality Application:Pharmaceutial

    Chamflyer Chemicals Co.Ltd is a fine organics manufacturing facility which located in Shanghai. We produce a wide range of boronic acids, pyridines, quinolines, indoles, oxazoles,

  • Shanghai chamflyer chemicals Co., Ltd

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+86-21-60545191

    Address:No 38 Debao Road, Pudong New District, Shanghai

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Specification

The 2-Propenal,3-(2-nitrophenyl)-, with CAS registry number 1466-88-2, belongs to the following product category: Aromatic Aldehydes & Derivatives (substituted). It has the systematic name of (2E)-3-(2-nitrophenyl)prop-2-enal. This chemical is a kind of light yellow to yellow-brown crystals or powder. And it should be stored in the refrigerator. And the chemical formula of this chemical is C9H7NO3.

Physical properties of 2-Propenal,3-(2-nitrophenyl)-: (1)ACD/LogP: 1.67; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 62.89 Å2; (7)Index of Refraction: 1.617; (8)Molar Refractivity: 48.87 cm3; (9)Molar Volume: 139.5 cm3; (10)Polarizability: 19.37×10-24cm3; (11)Surface Tension: 51.8 dyne/cm; (12)Density: 1.269 g/cm3; (13)Flash Point: 178.1 °C; (14)Enthalpy of Vaporization: 59.24 kJ/mol; (15)Boiling Point: 348.1 °C at 760 mmHg; (16)Vapour Pressure: 5.15E-05 mmHg at 25°C.

Uses of 2-Propenal,3-(2-nitrophenyl)-: it can be used to produce quinoline. This reaction will need reagents cysteine, ferrous ammonium sulfate, carbonate buffer and solvents ethanol, H2O. The reaction time is 15 hour(s) with reaction temperature of 50 ℃. The yield is about 76%.

Uses of 2-Propenal,3-(2-nitrophenyl)-: it can be used to produce quinoline.

When you are using this chemical, please be cautious about it as the following:
The 2-Propenal,3-(2-nitrophenyl)- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1ccccc1\C=C\C=O
(2)InChI: InChI=1/C9H7NO3/c11-7-3-5-8-4-1-2-6-9(8)10(12)13/h1-7H/b5-3+
(3)InChIKey: VMSMELHEXDVEDE-HWKANZROBN
(4)Std. InChI: InChI=1S/C9H7NO3/c11-7-3-5-8-4-1-2-6-9(8)10(12)13/h1-7H/b5-3+
(5)Std. InChIKey: VMSMELHEXDVEDE-HWKANZROSA-N