structural formula
business number | 039j |
---|---|
molecular formula | c10h9no9s3 |
molecular weight | 383.37 |
label |
heterocyclic compounds |
numbering system
cas number:118-03-6
mdl number:none
einecs number:none
rtecs number:none
brn number:none
pubchem id:none
physical property data
1. characteristics: light yellow trendy product
2. density (g/ml,20℃) : undetermined
3. relative vapor density (g/ml,air=1): undetermined
4. melting point (ºc): undetermined
5. boiling point (ºc,normal pressure): undetermined
6. boiling point (ºc, kpa): undetermined
7. refractive index: undetermined
8. flashpoint (ºc): undetermined
9. specific optical rotation (º): -62
10. autoignition point or ignition temperature (ºc): undetermined
11. vapor pressure (mmhg, ºc): undetermined
12. saturated vapor pressure (kpa, ºc): 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 limit (%,v/v): undetermined
<span lang=en-us style="font-size: 9pt; font-family: 宋体; mso- bidi-font-family: 宋体; mso-font-kerning: 0
2, moore volume (m3/mol):194.1
3、 isotonic specific volume (90.2k) :622.9
4, surface tension (dyne/cm):105.9
5、 polarizability (10-24cm3):31.30
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): -0.7
2. number of hydrogen bond donors: 4
3. number of hydrogen bond acceptors: 10
4. number of rotatable chemical bonds: 3
5. number of tautomers: none
6. topological molecule polar surface area 214
7. number of heavy atoms: 23
8. surface charge: 0
9. complexity: 756
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: 1
properties and stability
none
storage method
none
synthesis method
none
purpose
used in the manufacture of azo dyes and 2racid
-bidi-font-family: 宋体; mso-font-kerning: 0pt; mso-fareast-font-family: arial”> polarizability (10-24cm3):31.30
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): -0.7
2. number of hydrogen bond donors: 4
3. number of hydrogen bond acceptors: 10
4. number of rotatable chemical bonds: 3
5. number of tautomers: none
6. topological molecule polar surface area 214
7. number of heavy atoms: 23
8. surface charge: 0
9. complexity: 756
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: 1
properties and stability
none
storage method
none
synthesis method
none
purpose
used in the manufacture of azo dyes and 2racid