structural formula
| business number | 03cm |
|---|---|
| molecular formula | c9h11no |
| molecular weight | 149.19 |
| label |
n-acetyl o-[grass (above) + natto]amine, n-acetyl o-toluidine, o-methylacetanilide, o-methyl-n-acetylaniline, 2′-methylacetanilide, acetamide,n-(2-methylphenyl)-, acet-o-toluidide, n-(2-methylphenyl)-acetamid, n-(2-methylphenyl)acetamide, n-(2-methyl-phenyl)acetamide, o-tolylacetamide, o-methylacetanilide, n-acetyl-o-toluidine, aromatic compounds |
numbering system
cas number:120-66-1
mdl number:mfcd00014961
einecs number:204-414-4
rtecs number:an2900000
brn number:2207054
pubchem number:24852301
physical property data
molar refractive index:45.34
2、 molar volume (m3/mol): 138.7
3、 isotonic specific volume (90.2k): 348.6
4、 surface tension (dyne/cm):39.8
5、 dielectric constant:
6、 dipole moment（10-24cm3) ：
7、 polarizability:17.97
1. characteristics: colorless needle-shaped crystallization.
2. density ( g/ml,25/4℃) ：1.68
3. relative vapor density (g/ml,air=1): undetermined
4.es new roman'”> isotonic ratio（90.2k）：348.6
4. surface tension(dyne/cm)：39.8
5. dielectric constant:
6. dipole moment（10 -24cm3)：
7. polarizability: 17.97
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 1
4. number of rotatable chemical bonds: 1
5. number of tautomers: 3
6. topological molecule polar surface area 29.1
7. number of heavy atoms: 11
8. surface charge: 0
9. complexity: 145
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
1. basic properties
colorless needle-like crystals. soluble in ethanol, ether, benzene, chloroform and glacial acetic acid, slightly soluble in water.
storage method
stored in a sealed, cool place away from light.
synthesis method
none yet
purpose
organic synthesis.
��xlogp): none
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 1
4. rotatable chemical bonds number: 1
5. number of tautomers: 3
6. topological molecule polar surface area 29.1
7. number of heavy atoms: 11
8. surface charge: 0
9. complexity: 145
10. number of isotope atoms: 0
11. determine the atoms number of stereocenters: 0
12. uncertain number of stereocenters of atoms: 0
13. determined number of stereocenters of chemical bonds: 0
14. uncertain number of stereocenters of chemical bonds: 0
15. number of covalent bond units: 1
properties and stability
1. basic properties
colorless needle-like crystals. soluble in ethanol, ether, benzene, chloroform and glacial acetic acid, slightly soluble in water.
storage method
stored in a sealed, cool place away from light.
synthesis method
none yet
purpose
organic synthesis.
