2-(Butylamino)ethanol 2-(Butylamino)ethanol
Structural formula
| Business number | 0347 |
|---|---|
| Molecular formula | C6H15NO |
| Molecular weight | 117.19 |
| label |
Butylethanolamine, 2-Butylamine ethanol, N-Butyl-2-hydroxyethylamine, N-Butylethanolamine, linear compound |
Numbering system
CAS number:111-75-1
MDL number:MFCD00020570
EINECS number:203-904-5
RTECS number:KK0175000
BRN number:1732522
PubChem number:24870738
Physical property data
None
Toxicological data
None
Ecological data
None
Molecular structure data
5. Molecular property data:
1. Molar refractive index: 34.97
2. Molar volume (m3/mol）：133.8
3. Isotonic specific volume (90.2K):315.5
4. Surface Tension (dyne/cm):30.8
5. Polarizability（10-24cm3):13.86
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 0.4
2. Number of hydrogen bond donors: 2
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 5
5. Number of tautomers: none
6. Topological molecule polar surface area 32.3
7. Number of heavy atoms: 8
8. Surface charge: 0
9. Complexity: 39.5
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
None
