4,4′-Bisdimethylaminobenzyl alcohol
Structural formula
| Business number | 03B2 |
|---|---|
| Molecular formula | C17H22N2O |
| Molecular weight | 270.37 |
| label |
4,4′-Bis(dimethylamino)benzhydrol, BDC-OH, [(CH3)2NC6H4]2CHOH, Heterocyclic compounds |
Numbering system
CAS number:119-58-4
MDL number:MFCD00008313
EINECS number:204-335-5
RTECS number:DC7525000
BRN number:2131843
PubChem number:24888467
Physical property data
None yet
Toxicological data
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Ecological data
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Molecular structure data
5. Molecular property data:
1, Moore Refractive index: 85.73
2, Molar volume (m 3/mol）：243.0
3、 Isotonic specific volume (90.2K) ：637.7
4, Surface Tension (dyne/cm):47.3
5、 Polarizability (10-24cm3):33.98
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 3
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 4
5. Number of tautomers: none
6. Topological molecule polar surface area 26.7
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 249
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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Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 3
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 4
5. Number of tautomers: none
6. Topological molecule polar surface area 26.7
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 249
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