3-Amino-N,N-diethyl-4-nitrobenzamide supplier

Name
3-amino-N,N-diethyl-4-nitrobenzamide
EINECS
CAS No. 474020-77-4
Article Data2
CAS DataBase
Density 1.237 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₅N₃O₃
Boiling Point 465.36 °C at 760 mmHg
Molecular Weight 237.258
Flash Point 235.242 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Amino-N,N-diethyl-4-nitrobenzamid;benzamide, 3-amino-N,N-diethyl-4-nitro-;LogP
PSA 92.15000
LogP 2.76340

3-Amino-N,N-diethyl-4-nitrobenzamide Specification

The CAS registry number of Benzamide,3-amino-N,N-diethyl-4-nitro- is 474020-77-4.This chemical's molecular formula is C₁₁H₁₅N₃O₃ and molecular weight is 237.258. What's more, its systematic name is 3-Amino-N,N-diethyl-4-nitrobenzamide.

Physical properties about Benzamide,3-amino-N,N-diethyl-4-nitro- are: (1)ACD/LogP: 0.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 11; (6)ACD/BCF (pH 7.4): 11; (7)ACD/KOC (pH 5.5): 188; (8)ACD/KOC (pH 7.4): 188; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 92.15 Å²; (13)Index of Refraction: 1.589; (14)Molar Refractivity: 64.682 cm³; (15)Molar Volume: 191.859 cm³; (16)Polarizability: 25.642×10^-24cm³; (17)Surface Tension: 53.47 dyne/cm; (18)Density: 1.237 g/cm³; (19)Flash Point: 235.242 °C; (20)Enthalpy of Vaporization: 72.695 kJ/mol; (21)Boiling Point: 465.36 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=N(=O)c1ccc(cc1N)C(=O)N(CC)CC
(2)InChI: InChI=1/C11H15N3O3/c1-3-13(4-2)11(15)8-5-6-10(14(16)17)9(12)7-8/h5-7H,3-4,12H2,1-2H3
(3)InChIKey: LGCFYPZERIQCFE-UHFFFAOYAT

Product Name

3-amino-N,N-diethyl-4-nitrobenzamide

3-Amino-N,N-diethyl-4-nitrobenzamide Specification

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