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N-Ethyl-3-carbazolecarboxaldehyde

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Name

N-Ethyl-3-carbazolecarboxaldehyde

EINECS 231-471-2
CAS No. 7570-45-8 Density 1.14 g/cm3
PSA 22.00000 LogP 3.62690
Solubility Insoluble Melting Point 85-87 °C(lit.)
Formula C15H13NO Boiling Point 346.7 °C at 760 mmHg
Molecular Weight 223.274 Flash Point 163.5 °C
Transport Information N/A Appearance yellow to ochre crystalline powder or granules
Safety 26-36 Risk Codes 22-36
Molecular Structure Molecular Structure of 7570-45-8 (N-Ethyl-3-carbazolecarboxaldehyde) Hazard Symbols Xn,Xi
Synonyms

Carbazole-3-carboxaldehyde,9-ethyl- (6CI,7CI,8CI);3-Formyl-9-ethylcarbazole;3-Formyl-N-ethylcarbazole;9-Ethyl-3-carbazolecarboxaldehyde;9-Ethyl-3-formyl-9H-carbazole;9-Ethyl-3-formylcarbazole;9-Ethyl-9H-carbazole-3-aldehyde;9-Ethyl-9H-carbazole-3-carboxaldehyde;9-Ethyl-9H-carbazole-carbaldehyde;N-Ethyl-3-formylcarbazole;N-Ethyl-9H-carbazole-3-aldehyde;N-Ethylcarbazol-3-aldehyde;N-Ethylcarbazole-3-aldehyde;N-Ethylcarbazole-3-carboxaldehyde;NSC 231558;

Article Data 86

N-Ethyl-3-carbazolecarboxaldehyde Specification

The N-Ethyl-3-carbazolecarboxaldehyde with its cas register number is 7570-45-8. It also can be called as 9H-Carbazole-3-carboxaldehyde,9-ethyl- and the IUPAC Name about this chemical is 9-ethylcarbazole-3-carbaldehyde. It belongs to the following product categories, such as Aromatic Aldehydes & Derivatives (substituted), API intermediates, Carbazoles, Carbazoles (for Conduting Polymer Research), Functional Materials, Reagents for Conducting Polymer Research, Building Blocks, Heterocyclic Building Blocks and so on.

Physical properties about N-Ethyl-3-carbazolecarboxaldehyde are: (1)ACD/LogP: 3.94; (2)ACD/LogD (pH 5.5): 3.94; (3)ACD/LogD (pH 7.4): 3.94; (4)ACD/BCF (pH 5.5): 584.39; (5)ACD/BCF (pH 7.4): 584.39; (6)ACD/KOC (pH 5.5): 3326.65; (7)ACD/KOC (pH 7.4): 3326.65; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 22Å2; (11)Index of Refraction: 1.618; (12)Molar Refractivity: 68.64 cm3; (13)Molar Volume: 195.7 cm3; (14)Polarizability: 27.21x10-24cm3; (15)Surface Tension: 43 dyne/cm; (16)Enthalpy of Vaporization: 59.09 kJ/mol; (17)Vapour Pressure: 5.66E-05 mmHg at 25°C.

Uses of N-Ethyl-3-carbazolecarboxaldehyde: it can be used to produce 3-[3-(9-ethylcarbazolyl)]propenoic acid with malonic acid. This reaction needs Heating. It will need reagent2-methylpyridine with reaction time of 10 hours. The yield is about 36%.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes and it is harmful if swallowed. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCN1C2=C(C=C(C=C2)C=O)C3=CC=CC=C31
(2)InChI: InChI=1S/C15H13NO/c1-2-16-14-6-4-3-5-12(14)13-9-11(10-17)7-8-15(13)16/h3-10H,2H2,1H3
(3)InChIKey: QGJXVBICNCIWEL-UHFFFAOYSA-N

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