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| CAS No.: | 63224-44-2 |
|---|---|
| Name: | N-myristoyloxy-N-acetyl-2-aminofluorene |
| Molecular Structure: | |
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| Formula: | C29H39NO3 |
| Molecular Weight: | 449.69 |
| Synonyms: | N-Acetyl-N-myristoyloxy-2-aminofluorene;N-Myristoyloxy-aaf;N-(Fluoren-2-yl)-o-tetradecanoylacetohydroxamic acid;N-Myristoyloxy-N-acetyl-2-aminofluorene;Acetamide,N-9H-fluoren-2-yl-N-((1-oxotetradecyl)oxy);N-Acetyl-N-tetradecanoyloxy-2-aminofluorene;ACETOHYDROXAMIC ACID,N-(FLUOREN-2-YL)-O-TETRADECANOYL; |
| Density: | 1.075g/cm3 |
| Boiling Point: | 575.5°C at 760 mmHg |
| Flash Point: | 301.8°C |
| Safety: | Questionable carcinogen with experimental carcinogenic and neoplastigenic data. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx. |
| PSA: | 46.61000 |
| LogP: | 7.77000 |
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Chemistry
Molecule structure of N-Acetyl-N-myristoyloxy-2-aminofluorene (CAS NO.63224-44-2):
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IUPAC Name: [Acetyl(9H-fluoren-2-yl)amino] tetradecanoate
Molecular Weight: 449.62486 g/mol
Molecular Formula: C29H39NO3
Density: 1.075 g/cm3
Boiling Point: 575.5 °C at 760 mmHg
Flash Point: 301.8 °C
Index of Refraction: 1.558
Molar Refractivity: 134.77 cm3
Molar Volume: 418 cm3
Polarizability: 53.42×10-24 cm3
Surface Tension: 43.8 dyne/cm
Enthalpy of Vaporization: 86.19 kJ/mol
Vapour Pressure: 3.03E-13 mmHg at 25 °C
XLogP3-AA: 9.2
H-Bond Acceptor: 3
Rotatable Bond Count: 15
Exact Mass: 449.292994
MonoIsotopic Mass: 449.292994
Topological Polar Surface Area: 46.6
Heavy Atom Count: 33
Complexity: 591
Canonical SMILES: CCCCCCCCCCCCCC(=O)ON(C1=CC2=C(C=C1)C3=CC=CC=C3C2)C(=O)C
InChI: InChI=1S/C29H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-18-29(32)33-30(23(2)31)26-19-20-28-25(22-26)21-24-16-14-15-17-27(24)28/h14-17,19-20,22H,3-13,18,21H2,1-2H3
InChIKey: GRNOROTVWGAYBY-UHFFFAOYSA-N
Toxicity Data With Reference
| 1. | dns-hmn:fbr 10 µmol/L/5H | IJCNAW International Journal of Cancer. 16 (1975),284. | ||
| 2. | msc-ham:lng 50 µmol/L/3H | CALEDQ Cancer Letters (Shannon, Ireland). 6 (1979),67. | ||
| 3. | scu-rat TD:115 mg/kg/6W-I:CAR | CRNGDP Carcinogenesis. 2 (1981),655. |
Safety Profile
Questionable carcinogen with experimental carcinogenic and neoplastigenic data. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Specification
N-Acetyl-N-myristoyloxy-2-aminofluorene (CAS NO.63224-44-2) is also named as CCRIS 419 ; N-(Fluoren-2-yl)-o-tetradecanoylacetohydroxamic acid ; N-Acetyl-N-tetradecanoyloxy-2-aminofluorene ; N-Myristoyloxy-N-acetyl-2-aminofluorene ; N-Myristoyloxy-aaf ; Acetamide, N-9H-fluoren-2-yl-N-((1-oxotetradecyl)oxy)- ; Acetohydroxamic acid, N-(fluoren-2-yl)-O-tetradecanoyl- . N-Acetyl-N-myristoyloxy-2-aminofluorene (CAS NO.63224-44-2) is toxic. It is flammable. It will produce toxic nitrogen oxide fumes when buring. So the storage environment should be ventilate, low-temperature and dry.