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4-(Dimethylamino)-1-naphthaldehyde

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Name

4-(Dimethylamino)-1-naphthaldehyde

EINECS N/A
CAS No. 1971-81-9 Density 1.15 g/cm3
PSA 20.31000 LogP 2.71830
Solubility N/A Melting Point 43-45 °C(lit.)
Formula C13H13NO Boiling Point 346.6 °C at 760 mmHg
Molecular Weight 199.252 Flash Point 136.7 °C
Transport Information N/A Appearance N/A
Safety 26-37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 1971-81-9 (4-DIMETHYLAMINO-1-NAPHTHALDEHYDE) Hazard Symbols IrritantXi
Synonyms

4-(Dimethylamino)-1-naphthalenecarboxaldehyde;4-(Dimethylamino)-1-naphthaldehyde;1-Naphthaldehyde,4-(dimethylamino)- (6CI,7CI,8CI);

Article Data 10

4-(Dimethylamino)-1-naphthaldehyde Specification

The 1-Naphthalenecarboxaldehyde,4-(dimethylamino)-, with the CAS registry number 1971-81-9, is also known as 4-Dimethylamino-1-naphthaldehyde. It belongs to the product categories of Aldehydes; C10 to C21; Carbonyl Compounds. This chemical's molecular formula is C13H13NO and molecular weight is 199.25. Its systematic name is called 4-(dimethylamino)naphthalene-1-carbaldehyde. The product should be sealed and stored in cool, dry place.

Physical properties of 1-Naphthalenecarboxaldehyde,4-(dimethylamino)-: (1)ACD/LogP: 3.04; (2)ACD/LogD (pH 5.5): 3.04; (3)ACD/LogD (pH 7.4): 3.04; (4)ACD/BCF (pH 5.5): 120.48; (5)ACD/BCF (pH 7.4): 120.48; (6)ACD/KOC (pH 5.5): 1074.32; (7)ACD/KOC (pH 7.4): 1074.34; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.676; (11)Molar Refractivity: 65.16 cm3; (12)Molar Volume: 173.2 cm3; (13)Surface Tension: 48.9 dyne/cm; (14)Density: 1.15 g/cm3; (15)Flash Point: 136.7 °C; (16)Enthalpy of Vaporization: 59.08 kJ/mol; (17)Boiling Point: 346.6 °C at 760 mmHg; (18)Vapour Pressure: 5.69E-05 mmHg at 25°C.

Preparation: this chemical can be prepared by N,N-dimethyl-formamide and dimethyl-naphthalen-1-yl-amine. This reaction is a kind of Vilsmeier reaction. It will need reagent phosphoryl chloride and solvent toluene. The reaction time is 2 hours with reaction temperature of 30 - 80 °C. The yield is about 67%.

Uses of 1-Naphthalenecarboxaldehyde,4-(dimethylamino)-: it can be used to produce (4-dimethylamino-1-naphthyl)-tris(trimethylsilyl)silylmethanol at temperature of 20 °C. This reaction is a kind of Addition. It will need solvent tetrahydrofuran with reaction time of 24 hours. The yield is about 73%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2c1ccccc1c(cc2)N(C)C
(2)InChI: InChI=1/C13H13NO/c1-14(2)13-8-7-10(9-15)11-5-3-4-6-12(11)13/h3-9H,1-2H3
(3)InChIKey: XCQFZIFIUMBSAO-UHFFFAOYAK

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