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CAS No.: | 313279-12-8 |
---|---|
Name: | 2-Amino-3-nitrobenzamide |
Article Data: | 18 |
Molecular Structure: | |
Formula: | C7H7N3O3 |
Molecular Weight: | 181.151 |
Synonyms: | 2-Amino-3-nitrobenzamide; |
EINECS: | 200-258-5 |
Density: | 1.482 g/cm3 |
Melting Point: | 240-242℃ |
Boiling Point: | 319.22 °C at 760 mmHg |
Flash Point: | 146.859 °C |
PSA: | 114.93000 |
LogP: | 2.08060 |
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The CAS register number of Benzamide,2-amino-3-nitro- is 313279-12-8. It also can be called as 2-Amino-3-nitro-benzamide and the IUPAC name about this chemical is 2-amino-3-nitrobenzamide. The molecular formula about this chemical is C7H7N3O3 and the molecular weight is 181.148780 g/mol.
Physical properties about Benzamide,2-amino-3-nitro- are: (1)ACD/LogP: 1.63; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 10; (5)ACD/BCF (pH 7.4): 10; (6)ACD/KOC (pH 5.5): 183; (7)ACD/KOC (pH 7.4): 183; (8)#H bond acceptors: 6; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 114.93Å2; (12)Index of Refraction: 1.676; (13)Molar Refractivity: 45.965 cm3; (14)Molar Volume: 122.256 cm3; (15)Polarizability: 18.222x10-24cm3; (16)Surface Tension: 77.741 dyne/cm; (17)Enthalpy of Vaporization: 56.079 kJ/mol; (18)Boiling Point: 319.22 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c(c(c1)N(=O)=O)N)C(=O)N
(2)InChI: InChI=1/C7H7N3O3/c8-6-4(7(9)11)2-1-3-5(6)10(12)13/h1-3H,8H2,(H2,9,11)
(3)InChIKey: RMLPQVFYXZMJES-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C7H7N3O3/c8-6-4(7(9)11)2-1-3-5(6)10(12)13/h1-3H,8H2,(H2,9,11)
(5)Std. InChIKey: RMLPQVFYXZMJES-UHFFFAOYSA-N