1-Nitroanthraquinone 1-Nitroanthraquinione
Structural formula
| Business number | 01SU |
|---|---|
| Molecular formula | C14H7NO4 |
| Molecular weight | 253.21 |
| label |
None |
Numbering system
CAS number:82-34-8
MDL number:None
EINECS number:201-413-0
RTECS number:CB7940000
BRN number:None
PubChem ID:None
Physical property data
1. Character: yellow needle-like or prismatic crystal
2. Density (g/mL,25/4℃): Unsure
3. relativeVapor density (g/mL,Air=1 ): Unsure
4. Melting point (ºC): 230
5. Boiling point (ºC,Normal pressure):270℃（ 0.93kPa).
6. Boiling point (ºC,5.2kPa): Unsure
7. Refractive index: Uncertain
8. Flashpoint (ºC): Unsure
9. Specific optical rotation (º): Unsure
10. Autoignition point or ignition temperature (ºC): Unsure
11. Vapor pressure (kPa,25ºC): Unsure
12. Saturated vapor pressure (2. Teratogenicity: Microorganisms: 100 ug/plate
3 , Neurotoxicity:
Rabbit skin test: 500 mg/24HREACTION; Rabbit eye test: 100 mg/24HREACTIONEcological data
None yet
Molecular structure data
1. Molar refractive index: 65.21
2. Molar volume (m3/mol）：170.9
3. isotonic specific volume (90.2K):491.9
4. Surface Tension (dyne/cm):68.6
5. Polarizability（10-24cm3):25.85
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 80
7. Number of heavy atoms: 19
8. Surface charge: 0
9. Complexity: 428
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
Yellow needle-like or prismatic crystals. Melting point230℃, boiling point 270℃（0.93kPa). Meltable in alcohol and ether, slightly soluble in ethyl acetate, benzene, chloroform and acetic acid, insoluble in water. It is brown in sulfuric acid.
Storage method
Seal and store in a dark place.
Synthesis method
Obtained from the nitration of anthraquinone.
Purpose
This product is a dye intermediate and is used for production1-Aminoanthraquinone,1,5-and1,8-Dinitrate Anthraquinone.
��68.6
5. Polarizability（10-24cm3):25.85
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 80
7. Number of heavy atoms: 19
8. Surface charge: 0
9. Complexity: 428
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
Yellow needle-like or prismatic crystals. Melting point230℃, boiling point 270℃（0.93kPa). Meltable in alcohol and ether, slightly soluble in ethyl acetate, benzene, chloroform and acetic acid, insoluble in water. It is brown in sulfuric acid.
Storage method
Seal and store in a dark place.
Synthesis method
Obtained from the nitration of anthraquinone.
Purpose
This product is a dye intermediate and is used for production1-Aminoanthraquinone,1,5-and1,8-Dinitrate Anthraquinone.
Arial; mso-font-kerning: 0pt”>Aminoanthraquinone, 1,5-and 1,8-Dinitroanthraquinone.