structural formula
| business number | 01qv |
|---|---|
| molecular formula | c10h9cln4o2s |
| molecular weight | 284.72 |
| label |
sulfadimethine, 4-amino-n-(6-chloro-3-pyridazinyl)benzenesulfonamide |
numbering system
cas number:80-32-0
mdl number:mfcd00057371
einecs number:201-269-9
rtecs number:none
brn number:261558
pubchem number:24899860
physical property data
1. physical property data
1. character: uncertain.
2. density (g/ml,25/4℃): unsure
3. relative vapor density (g/ml,air=1): unsure
4. melting point (ºc): unsure
5. boiling point (ºc,normal pressure): uncertain
6. boiling point (ºc,5.2kpa): unsure
7. refractive index: uncertain
8. flash point (ºc): unsure
9. specific optical rotation (º): unsure
10. autoignition point or ignition temperature (ºc): unsure
11. vapor pressure (kpa,25ºc): unsure
17. explosion limit (%,v/v): unsure
18. lower explosion limit (%,v/v): unsure
19. solubility: uncertain.
toxicological data
none yet
ecological data
none yet
molecular structure data
5. molecular property data:
1. molar refractive index: 67.97
2. molar volume (m3/mol）：179.2
3. isotonic specific volume (90.2k):541.5
4. surface tension (dyne/cm):83.3
5. polarizability（10-24cm3):26.94
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 6
4. number of rotatable chemical bonds: 3
5. number of tautomers: 2
6. topological molecule polar surface area 106
7. number of heavy atoms: 18
8. surface charge: 0
9. complexity: 365
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 yet
storage method
none yet
synthesis method
none yet
purpose
none yet
2. molar volume (m3/mol): 179.2
3. isotonic specific volume (90.2k):541.5
4. surface tension (dyne/cm):83.3
5. polarizability（10-24cm3):26.94
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 6
4. number of rotatable chemical bonds: 3
5. number of tautomers: 2
6. topological molecule polar surface area 106
7. number of heavy atoms: 18
8. surface charge: 0
9. complexity: 365
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 yet
storage method
none yet
synthesis method
none yet
purpose
none yet
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