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79606-43-2

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Basic Information
CAS No.: 79606-43-2
Name: N,N-DIISOPROPYL-4-METHOXYBENZAMIDE
Article Data: 18
Molecular Structure:
Molecular Structure of 79606-43-2 (N,N-DIISOPROPYL-4-METHOXYBENZAMIDE)
Formula: C14H21NO2
Molecular Weight: 235.326
Synonyms: N,N-Diisopropyl-4-methoxybenzamide;NSC 404046;
Density: 0.999 g/cm3
Boiling Point: 359.4 °C at 760 mmHg
Flash Point: 171.1 °C
PSA: 29.54000
LogP: 2.95420
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Specification

The Benzamide, 4-methoxy-N,N-bis(1-methylethyl)-, with the CAS registry number 79606-43-2, is also known as N,N-Diisopropyl-4-methoxybenzamide. This chemical's molecular formula is C14H21NO2 and molecular weight is 235.32. What's more, both its IUPAC name and systematic name are the same which is called 4-methoxy-N,N-di(propan-2-yl)benzamide. 

Physical properties about Benzamide, 4-methoxy-N,N-bis(1-methylethyl)- are: (1)ACD/LogP: 2.72; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 29.54 Å2; (7)Index of Refraction: 1.504; (8)Molar Refractivity: 69.76 cm3; (9)Molar Volume: 235.5 cm3; (10)Polarizability: 27.65×10-24 cm3; (11)Surface Tension: 33.9 dyne/cm; (12)Density: 0.999 g/cm3; (13)Flash Point: 171.1 °C; (14)Enthalpy of Vaporization: 60.5 kJ/mol; (15)Boiling Point: 359.4 °C at 760 mmHg; (16)Vapour Pressure: 2.39E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(OC)cc1)N(C(C)C)C(C)C
(2)InChI: InChI=1/C14H21NO2/c1-10(2)15(11(3)4)14(16)12-6-8-13(17-5)9-7-12/h6-11H,1-5H3
(3)InChIKey: IZNMHGFRJFLYSK-UHFFFAOYAT