Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
6-Hydroxy-7-nitro-1-indanone |
EINECS | N/A |
CAS No. | 85515-22-6 | Density | 1.541 g/cm3 |
PSA | 83.12000 | LogP | 1.95250 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H7NO4 | Boiling Point | 369.3 °C at 760 mmHg |
Molecular Weight | 193.16 | Flash Point | 166.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1H-inden-1-one, 2,3-dihydro-6-hydroxy-7-nitro-; |
Article Data | 4 |
The CAS register number of 6-Hydroxy-7-nitro-1-indanone is 85515-22-6. It also can be called as 1H-inden-1-one, 2,3-dihydro-6-hydroxy-7-nitro- and the systematic name about this chemical is 6-hydroxy-7-nitro-2,3-dihydro-1H-inden-1-one. The molecular formula about this chemical is C9H7NO4 and the molecular weight is 193.16.
Physical properties about 6-Hydroxy-7-nitro-1-indanone are: (1)ACD/LogP: 1.94; (2)#H bond acceptors: 5; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 72.12Å2; (6)Index of Refraction: 1.673; (7)Molar Refractivity: 46.98 cm3; (8)Molar Volume: 125.2 cm3; (9)Polarizability: 18.62x10-24cm3; (10)Surface Tension: 76 dyne/cm; (11)Enthalpy of Vaporization: 64.03 kJ/mol; (12)Boiling Point: 369.3 °C at 760 mmHg; (13)Vapour Pressure: 5.63E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1c(O)ccc2c1C(=O)CC2
(2)InChI: InChI=1/C9H7NO4/c11-6-3-1-5-2-4-7(12)9(8(5)6)10(13)14/h2,4,12H,1,3H2
(3)InChIKey: OMSIDHRDOFJRKC-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C9H7NO4/c11-6-3-1-5-2-4-7(12)9(8(5)6)10(13)14/h2,4,12H,1,3H2
(5)Std. InChIKey: OMSIDHRDOFJRKC-UHFFFAOYSA-N