structural formula
| business number | 01bu |
|---|---|
| molecular formula | c10h12n2o·c4h9n3o5s·h2o |
| molecular weight | 405.43 |
| label |
5-hydroxytryptamine creatinine sulfate |
numbering system
cas number:61-47-2
mdl number:mfcd00149653
einecs number:213-539-3
rtecs number:nm2550000
brn number:3886526
pubchem id:none
physical property data
1. characteristics: white flaky crystals. sensitive to light and moisture.
2. density (g/ml,25/4℃): undetermined
3. relative vapor density (g/ml,air=1): undetermined
4. melting point (ºc):215℃ (decomposition)
5. boiling point (ºc,normal pressure): undetermined
6. boiling point (ºc,5.2kpa): undetermined
7. refractive index: undetermined
8. flashpoint (ºc): undetermined
9. specific optical rotation (º): undetermined
10. autoignition point or ignition temperature (ºc): undetermined
11. vapor pressure (kpa,25ºc): undetermined
12. saturation vapor pressure (kpa,60ºc): undetermined
13. heat of combustion (kj/mol): undetermined
14. critical temperature (ºc): undetermined
15. critical pressure (kpa): not ok
16. oil and water (octanol/logarial value of the partition coefficient of water: undetermined
17. explosion limit (%,v/v): undetermined
18. lower explosion limit (%,v/v): undetermined
19. solubility: solubility in water:27℃,20mg/ml ;50℃,100mg/ml. soluble in acetic acid, slightly soluble in methanol and95%ethanol, insoluble in anhydrous ethanol, acetone, pyridine, chloroform, ethyl acetate, benzene and diethyl ether. 0.01mol/laqueousphfor3.6.
toxicological data
none yet
ecological data
none yet
molecular structure data
none yet
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 7
3. number of hydrogen bond acceptors: 8
4. number of rotatable chemical bonds: 2
5. number of tautomers: 45
6. topological molecule polar surface area 205
7. number of heavy atoms: 27
8. surface charge: 0
9. complexity: 407
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: 4
properties and stability
none yet
storage method
this product should be sealed in4 store in dry condition.
synthesis method
none yet
purpose
biochemical research.
“>95%ethanol, insoluble in absolute ethanol, acetone, pyridine, chloroform, ethyl acetate, benzene and ether.0.01mol/laqueous solutionphfor3.6.
toxicological data
none yet
ecological data
none yet
molecular structure data
none yet
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 7
3. number of hydrogen bond acceptors: 8
4. number of rotatable chemical bonds: 2
5. number of tautomers: 45
6. topological molecule polar surface area 205
7. number of heavy atoms: 27
8. surface charge: 0
9. complexity: 407
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: 4
properties and stability
none yet
storage method
this product should be sealed in4 store in dry condition.
synthesis method
none yet
purpose
biochemical research.
微信扫一扫打赏
