n-cyclohexyl-p-toluenesulfonamide n-cyclohexyl-p-toluenesulfonamide
structural formula
| business number | 01qu |
|---|---|
| molecular formula | c13h19no2s |
| molecular weight | 253.36 |
| label |
none |
numbering system
cas number:80-30-8
mdl number:mfcd00014285
einecs number:201-268-3
rtecs number:xt5617000
brn number:2698317
pubchem id:none
physical property data
1. physical property data
1. characteristics: uncertain.
2. density (g/ml,25/4℃): unsure
3. relative vapor density (g/ml,air=1): unsure
4. melting point (ºc):84 -85°c
5. boiling point (ºc,normal pressure):282-283
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
12. saturated vapor pressure (kpa,60ºcexplosion limit (%,v/v): unsure
18. lower explosion limit (%,v/v): unsure
19. solubility:<0.1 g/100 ml at 21°c
toxicological data
1, acute toxicity
rat caliber ld50: >500mg/kg;
ecological data
none yet
molecular structure data
5. molecular property data:
1. molar refractive index: 69.56
2. molar volume (m3/mol）：213.8
3. isotonic specific volume (90.2k):558.7
4. surface tension (dyne/cm):46.5
5. polarizability（10-24cm3):27.57
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 3.1
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 3
4. number of rotatable chemical bonds: 3
5. number of tautomers: none
6. topological molecule polar surface area 54.6
7. number of heavy atoms: 17
8. surface charge: 0
9. complexity: 320
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
level2 lfo1; mso-margin-top-alt: auto; mso-margin-bottom-alt: auto” align=left>2. moore volume (m3/mol): 213.8
3. isotonic specific volume (90.2k):558.7
4. surface tension (dyne/cm):46.5
5. polarizability（10-24cm3):27.57
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 3.1
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 3
4. number of rotatable chemical bonds: 3
5. number of tautomers: none
6. topological molecule polar surface area 54.6
7. number of heavy atoms: 17
8. surface charge: 0
9. complexity: 320
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
