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| Name |
N-Acetyl-3,5-dinitro-L-tyrosine |
EINECS | N/A |
| CAS No. | 20767-00-4 | Density | 1.608 g/cm3 |
| PSA | 178.27000 | LogP | 1.77770 |
| Solubility | N/A | Melting Point |
189-190 °C |
| Formula | C11H11N3O8 | Boiling Point | 583.17 °C at 760 mmHg |
| Molecular Weight | 313.224 | Flash Point | 306.49 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Tyrosine,N-acetyl-3,5-dinitro-, L- (8CI);3,5-Dinitro-N-acetyl-L-tyrosine;N-Acetyl-3,5-dinitro-L-tyrosine;NSC 83259; |
N-Acetyl-3,5-dinitro-L-tyrosine Chemical Properties
Product Name: N-Acetyl-3,5-dinitro-L-tyrosine (CAS NO.20767-00-4)
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Molecular Formula: C11H11N3O8
Molecular Weight: 313.22g/mol
Mol File: 20767-00-4.mol
Boiling point: 583.2 °C at 760 mmHg
Storage Temperature: 2-8°C
Flash Point: 306.5 °C
Density: 1.607 g/cm3
Surface Tension: 79.3 dyne/cm
Enthalpy of Vaporization: 91.69 kJ/mol
Vapour Pressure: 1.92E-14 mmHg at 25°C
XLogP3-AA: 1
H-Bond Donor: 3
H-Bond Acceptor: 8
Structure Descriptors of N-Acetyl-3,5-dinitro-L-tyrosine (CAS NO.20767-00-4):
IUPAC Name: 2-acetamido-3-(4-hydroxy-3,5-dinitrophenyl)propanoic acid
Canonical SMILES: CC(=O)NC(CC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-])C(=O)O
InChI: InChI=1S/C11H11N3O8/c1-5(15)12-7(11(17)18)2-6-3-8(13(19)20)10(16)9(4-6)14(21)22/h3-4,7,16H,2H2,1H3,(H,12,15)(H,17,18)
InChIKey: CFKZKLOBRPCKTF-UHFFFAOYSA-N
Product Categories: Tyrosine [Tyr, Y]; A - H; Amino Acids; Modified Amino Acids
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