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Cas Database |
| Name |
Aceticacid, 2-[(1,1-dimethylethyl)nitrosoamino]- |
EINECS | N/A |
| CAS No. | 6939-24-8 | Density | 1.15 g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C6H12N2O3 | Boiling Point | 326 °C at 760 mmHg |
| Molecular Weight | 160.173 | Flash Point | 150.9 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Glycine, N-(1,1-dimethylethyl)-N-nitroso-(9CI);Glycine, N-tert-butyl-N-nitroso-(7CI);N-tert-Butyl-N-nitrosoglycine;NSC 56794;[Tert-butyl(nitroso)amino]acetic acid;AC1Q5WJX;AC1L6FB8;KST-1A8385;AR-1A9275;CID245168;2-[Tert-butyl(nitroso)amino]acetic acid; |
Article Data | 5 |
Aceticacid, 2-[(1,1-dimethylethyl)nitrosoamino]- Specification
The Aceticacid, 2-[(1,1-dimethylethyl)nitrosoamino]- with CAS registry number of 6939-24-8 is also known as [Tert-butyl(nitroso)amino]acetic acid. The IUPAC name is 2-[Tert-butyl(nitroso)amino]acetic acid. In addition, the formula is C6H12N2O3 and the molecular weight is 160.17.
Physical properties about Aceticacid, 2-[(1,1-dimethylethyl)nitrosoamino]- are: (1)ACD/LogP: 0.23; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 58.97Å2; (7)Index of Refraction: 1.482; (8)Molar Refractivity: 39.73 cm3; (9)Molar Volume: 139.1 cm3; (10)Polarizability: 15.75×10-24cm3; (11)Surface Tension: 39.6 dyne/cm; (12)Density: 1.15 g/cm3; (13)Flash Point: 150.9 °C; (14)Enthalpy of Vaporization: 62.46 kJ/mol; (15)Boiling Point: 326 °C at 760 mmHg; (16)Vapour Pressure: 4.47E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
1. SMILES: O=C(O)CN(N=O)C(C)(C)C
2. InChI: InChI=1/C6H12N2O3/c1-6(2,3)8(7-11)4-5(9)10/h4H2,1-3H3,(H,9,10)
3. InChIKey: VOYWEVGGNUNHMZ-UHFFFAOYAL
4. Std. InChI: InChI=1S/C6H12N2O3/c1-6(2,3)8(7-11)4-5(9)10/h4H2,1-3H3,(H,9,10)
5. Std. InChIKey: VOYWEVGGNUNHMZ-UHFFFAOYSA-N
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