Structural formula
Business number | 03ZY |
---|---|
Molecular formula | C6H14N4O2 |
Molecular weight | 174.20 |
label |
None |
Numbering system
CAS number:157-06-2
MDL number:MFCD00063116
EINECS number:205-866-5
RTECS number:CF1934220
BRN number:1725412
PubChem ID:None
Physical property data
1. Characteristics: White crystal
2. Density (g/mL,25/4℃): Undetermined
3. Relative vapor density (g/mL,Air =1): Undetermined
4. Melting point (ºC):238( Decompose)
5. Boiling point (ºC,normal pressure): Undetermined
6. Boiling point (ºC,5.2kPa): Not determined
7. Refractive index: Undetermined
8. Flashpoint (ºC): Undetermined
9. Specific rotation (º): [а]D/25-27.6°(c=2.5mol/Lin hydrochloric acid)-12.5°(c=2, in water ).
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (kPa,25ºC): Undetermined
12. Saturated vapor pressure (kPa,60ºC): Undetermined
13. Heat of combustion (KJ/mol): Undetermined
14. Critical temperature (ºC): Undetermined
15. Critical pressure (KPa): Undetermined
16. Oil and water (octanol/Log value of the partition coefficient for water: undetermined
17. Explosion upper limit (%,V/V): Undetermined
18. Lower explosion limit (%,V/V): Undetermined
19. Solubility:Soluble in water
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
1. Molar refractive index:40.69
2. Molar Volume(m3/mol):118.7
3. Isotonic specific volume(90.2K):338.5
4. Surface tension(dyne/cm): 66.1
5. Dielectric constant: None available
6. Dipole moment(10-24cm3) : Not available
7. Polarizability:16.13
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 4
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 5
5. Number of tautomers: 2
6. Topological molecule polar surface area 128
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 176
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 1
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
None yet
Storage method
Store in a sealed, dry and away from light
Synthesis method
None yet
Purpose
Biochemical Research
-54.75pt; TEXT-ALIGN: left; mso-list: l0 level2 lfo1; tab-stops: list 36.0pt; mso-margin-top-alt: auto; mso-margin-bottom-alt: auto” align=left> 4. Surface tension( dyne/cm): 66.1
5. Dielectric constant: None available
6. Dipole moment(10-24cm3) : Not available
7. Polarizability:16.13
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 4
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 5
5. Number of tautomers: 2
6. Topological molecule polar surface area 128
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 176
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 1
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
None yet
Storage method
Store in a sealed, dry and away from light
Synthesis method
None yet
Purpose
Biochemical Research
un: yes”> Seal Store dry and away from light
Synthesis method
None yet
Purpose
Biochemical Research