Structural formula
Business number | 02SQ |
---|---|
Molecular formula | C22H42O4 |
Molecular weight | 370.57 |
label |
None yet |
Numbering system
CAS number:106-12-7
MDL number:None
EINECS number:203-364-0
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
None yet
Toxicological data
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Ecological data
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Molecular structure data
1. Molar refractive index: 109.08
2. Molar volume (cm3/mol): 392.6
3. Isotonic specific volume (90.2K ): 955.7
4. Surface tension (dyne/cm): 35.1
5. Dielectric constant:
6. Dipole moment (10-24cm3):
7. Polarizability: 43.24
Compute chemical data
1. Hydrophobic parameter calculation reference value (XlogP): 6.8
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 21
5. Number of tautomers:
6. Topological molecular polar surface area (TPSA): 55.8
7. Number of heavy atoms: 26
8. Surface charge: 0
9. Complexity: 315
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 Number: 1
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
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Storage method
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Synthesis method
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Purpose
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