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Benzamide,N-(5-chloro-2-methoxy-4-nitrophenyl)-

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Name

Benzamide,N-(5-chloro-2-methoxy-4-nitrophenyl)-

EINECS 261-730-5
CAS No. 59385-63-6 Density 1.419 g/cm3
PSA 87.64000 LogP 4.41630
Solubility N/A Melting Point N/A
Formula C14H11ClN2O4 Boiling Point 393.9 °C at 760 mmHg
Molecular Weight 306.705 Flash Point 192 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 59385-63-6 (N-(5-chloro-2-methoxy-4-nitrophenyl)benzamide) Hazard Symbols N/A
Synonyms

o-Benzanisidide,5'-chloro-4'-nitro- (6CI);1-Benzamido-5-chloro-2-methoxy-4-nitrobenzene;

 

Benzamide,N-(5-chloro-2-methoxy-4-nitrophenyl)- Specification

The CAS registry number of Benzamide,N-(5-chloro-2-methoxy-4-nitrophenyl)- is 59385-63-6. Its EINECS registry number is 261-730-5. This chemical's molecular formula is C14H11ClN2O4 and molecular weight is 306.7011. What's more, its systematic name is N-(5-Chloro-2-methoxy-4-nitrophenyl)benzamide.

Physical properties about Benzamide,N-(5-chloro-2-methoxy-4-nitrophenyl)- are: (1)ACD/LogP: 3.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.93; (4)ACD/LogD (pH 7.4): 3.93; (5)ACD/BCF (pH 5.5): 571.01; (6)ACD/BCF (pH 7.4): 570.87; (7)ACD/KOC (pH 5.5): 3271.97; (8)ACD/KOC (pH 7.4): 3271.18; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 75.36 Å2; (13)Index of Refraction: 1.651; (14)Molar Refractivity: 78.94 cm3; (15)Molar Volume: 216 cm3; (16)Polarizability: 31.29×10-24 cm3; (17)Surface Tension: 57.4 dyne/cm; (18)Density: 1.419 g/cm3; (19)Flash Point: 192 °C; (20)Enthalpy of Vaporization: 64.38 kJ/mol; (21)Boiling Point: 393.9 °C at 760 mmHg; (22)Vapour Pressure: 2.06E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cc(OC)c(cc1Cl)NC(=O)c2ccccc2
(2)InChI: InChI=1/C14H11ClN2O4/c1-21-13-8-12(17(19)20)10(15)7-11(13)16-14(18)9-5-3-2-4-6-9/h2-8H,1H3,(H,16,18)
(3)InChIKey: HGVDYDIWZCHHKB-UHFFFAOYAH

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