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Name |
Selenophene, 2-nitro- |
EINECS | N/A |
CAS No. | 15429-04-6 | Density | N/A |
PSA | 45.82000 | LogP | 1.17500 |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H3NO2Se | Boiling Point | 232.8 °C at 760 mmHg |
Molecular Weight | 176.033 | Flash Point | 94.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Nitroselenophene; |
The Selenophene, 2-nitro- is an organic compound with the formula C4H3NO2Se. With the CAS registry number 15429-04-6, the IUPAC name of this chemical is 2-nitroselenophene.
Physical properties about Selenophene, 2-nitro- are: (1)ACD/LogP: 1.22; (2)ACD/LogD (pH 5.5): 1.22; (3)ACD/LogD (pH 7.4): 1.22; (4)ACD/BCF (pH 5.5): 5; (5)ACD/BCF (pH 7.4): 5; (6)ACD/KOC (pH 5.5): 110.13; (7)ACD/KOC (pH 7.4): 110.13; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 45.82 Å2; (11)Flash Point: 94.6 °C; (12)Enthalpy of Vaporization: 45.05 kJ/mol; (13)Boiling Point: 232.8 °C at 760 mmHg; (14)Vapour Pressure: 0.0879 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1[se]ccc1
(2)InChI: InChI=1/C4H3NO2Se/c6-5(7)4-2-1-3-8-4/h1-3H
(3)InChIKey: NTGDQUUAYXNMDR-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C4H3NO2Se/c6-5(7)4-2-1-3-8-4/h1-3H
(5)Std. InChIKey: NTGDQUUAYXNMDR-UHFFFAOYSA-N