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78238-13-8

Basic Information
CAS No.: 78238-13-8
Name: ethyl 3-methoxy-5-nitrobenzoate
Article Data: 12
Molecular Structure:
Molecular Structure of 78238-13-8 (ethyl 3-methoxy-5-nitrobenzoate)
Formula: C9H9NO5
Molecular Weight: 211.174
Synonyms: 3-Methoxy-5-nitrobenzoicacid methyl ester;Methyl 3-methoxy-5-nitrobenzoate;
Density: 1.294 g/cm3
Melting Point: 88-90 °C
Boiling Point: 342.9 °C at 760 mmHg
Flash Point: 163.2 °C
PSA: 81.35000
LogP: 1.91320
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    SAGECHEM/ethyl 3-methoxy-5-nitrobenzoate/SAGECHEM/Manufacturer in China

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    SAGECHEM is a chemical R&D, manufacturing and distribution company in China since 2009, including pharmaceutical intermediates, agrochemical, dyestuff intermediates, organosilicone, API and etc. We also offer a full range of services in custom synthe

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  • 78238-13-8  C10H11NO5  ethyl 3-methoxy-5-nitrobenzoate

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    78238-13-8 C10H11NO5 ethyl 3-methoxy-5-nitrobenzoate

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    78238-13-8 C10H11NO5 ethyl 3-methoxy-5-nitrobenzoateAppearance:As detailed Storage:room temperature Package:As required Application:78238-13-8 Transportation:By air/sea/express

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  • Benzoic acid,3-methoxy-5-nitro-, methyl ester

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    Benzoic acid,3-methoxy-5-nitro-, methyl ester

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    Methyl 3-methoxy-5-nitrobenzoate

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Specification

The Benzoic acid,3-methoxy-5-nitro-, methyl ester, with the CAS registry number 78238-13-8, is also known as 3-Methoxy-5-nitrobenzoicacid methyl ester. This chemical's molecular formula is C9H9NO5 and molecular weight is 211.17. What's more, its systematic name is Methyl 3-methoxy-5-nitrobenzoate.

Physical properties of Benzoic acid,3-methoxy-5-nitro-, methyl ester are: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 81.35 Å2; (7)Index of Refraction: 1.54; (8)Molar Refractivity: 51.25 cm3; (9)Molar Volume: 163.1 cm3; (10)Polarizability: 20.31×10-24 cm3; (11)Surface Tension: 45.7 dyne/cm; (12)Density: 1.294 g/cm3; (13)Flash Point: 163.2 °C; (14)Enthalpy of Vaporization: 58.67 kJ/mol; (15)Boiling Point: 342.9 °C at 760 mmHg; (16)Vapour Pressure: 7.28E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(cc(OC)c1)C(=O)OC
(2)InChI: InChI=1S/C9H9NO5/c1-14-8-4-6(9(11)15-2)3-7(5-8)10(12)13/h3-5H,1-2H3
(3)InChIKey: OSTVXCVLGHROLX-UHFFFAOYSA-N