Benzamide,N-methyl-4-nitro- supplier

Name
N-Methyl-4-Nitro-Benzamide
EINECS
CAS No. 2585-23-1
Article Data39
CAS DataBase
Density 1.272 g/cm³
Solubility
Melting Point 219 °C
Formula C₈H₈N₂O₃
Boiling Point 382.6 °C at 760 mmHg
Molecular Weight 180.163
Flash Point 185.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzamide,N-methyl-p-nitro- (6CI,7CI,8CI);N-Methyl-4-nitrobenzamide;N-Methyl-p-nitrobenzamide;NSC 406838;
PSA 74.92000
LogP 1.86850

Benzamide,N-methyl-4-nitro- Specification

The Benzamide,N-methyl-4-nitro-, with the CAS registry number 2585-23-1, is also known as N-methyl(4-nitrophenyl)carboxamide. This chemical's molecular formula is C₈H₈N₂O₃ and molecular weight is 180.16. What's more, its systematic name is N-methyl-4-nitrobenzamide.

Physical properties of Benzamide,N-methyl-4-nitro- are: (1)ACD/LogP: 1.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.02; (4)ACD/LogD (pH 7.4): 1.02; (5)ACD/BCF (pH 5.5): 3.52; (6)ACD/BCF (pH 7.4): 3.52; (7)ACD/KOC (pH 5.5): 85.59; (8)ACD/KOC (pH 7.4): 85.59; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 66.13 Å²; (13)Index of Refraction: 1.569; (14)Molar Refractivity: 46.42 cm³; (15)Molar Volume: 141.6 cm³; (16)Polarizability: 18.4×10^-24 cm³; (17)Surface Tension: 49.6 dyne/cm; (18)Density: 1.272 g/cm³; (19)Flash Point: 185.2 °C; (20)Enthalpy of Vaporization: 63.11 kJ/mol; (21)Boiling Point: 382.6 °C at 760 mmHg; (22)Vapour Pressure: 4.65E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
(2)InChI: InChI=1S/C8H8N2O3/c1-9-8(11)6-2-4-7(5-3-6)10(12)13/h2-5H,1H3,(H,9,11)
(3)InChIKey: UZWAQQSVGQEZRY-UHFFFAOYSA-N

Product Name

N-Methyl-4-Nitro-Benzamide

Benzamide,N-methyl-4-nitro- Specification

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