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Benzaldehyde,4-(dimethylamino)-3-nitro-

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Name

Benzaldehyde,4-(dimethylamino)-3-nitro-

EINECS N/A
CAS No. 59935-39-6 Density 1.286 g/cm3
PSA 66.13000 LogP 1.99650
Solubility N/A Melting Point 105-107 °C
Formula C9H10N2O3 Boiling Point 335.9 °C at 760 mmHg
Molecular Weight 194.19 Flash Point 156.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 59935-39-6 (4-(Dimethylamino)-3-nitrobenzaldehyde) Hazard Symbols IrritantXi
Synonyms

4-Dimethylamino-3-nitrobenzaldehyde;NSC 156545;4-Dimethylamino-3-nitro-benzaldehyde;

Article Data 9

Benzaldehyde,4-(dimethylamino)-3-nitro- Specification

The Benzaldehyde,4-(dimethylamino)-3-nitro-, with the CAS registry number 59935-39-6, is also known as 4-Dimethylamino-3-nitro-benzaldehyde. This chemical's molecular formula is C9H10N2O3 and molecular weight is 194.1873. What's more, both its IUPAC name and systematic name are the same which is called 4-Dimethylamino-3-nitrobenzaldehyde.

Physical properties about Benzaldehyde,4-(dimethylamino)-3-nitro- are: (1) ACD/LogP: 1.98; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 5; (4) #H bond donors: 0; (5) #Freely Rotating Bonds: 3; (6) Polar Surface Area: 66.13 Å2; (7) Index of Refraction: 1.632; (8) Molar Refractivity: 53.86 cm3; (9) Molar Volume: 150.9 cm3; (10) Polarizability: 21.35×10-24 cm3; (11) Surface Tension: 54.3 dyne/cm; (12) Density: 1.286 g/cm3; (13) Flash Point: 156.9 °C; (14) Enthalpy of Vaporization: 57.9 kJ/mol; (15) Boiling Point: 335.9 °C at 760 mmHg; (16) Vapour Pressure: 0.000116 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c1cc(ccc1N(C)C)C=O
(2) InChI: InChI=1/C9H10N2O3/c1-10(2)8-4-3-7(6-12)5-9(8)11(13)14/h3-6H,1-2H3
(3) InChIKey: BMMZDXZYHYBOOQ-UHFFFAOYAE

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