Hydroxy-2-naphthoic acid phenyl ester

Structural formula

• Numbering system
• Physical property data
• Toxicological data
• Ecological data
• Molecular structure data
• Computing chemical data
• More
  • Properties and Stability
  • Storage method
  • Synthesis method
  • Purpose

Numbering system

CAS number:132-54-7

MDL number:MFCD00014310

EINECS number:205-065-0

RTECS number:None

BRN number:2217072

PubChem number:24864125

Physical property data

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Toxicological data

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Ecological data

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Molecular structure data

5. Molecular property data:

1、 Molar refractive index:77.62

2、 Molar volume(m³/mol): 205.3

3、 Isotonic specific volume（90.2K）：563.5

4、 Surface tension(3.0 dyne/cm):56.6

5、 Polarizability0.5 10^-24 cm³):30.77

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 4.8

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: 3

6. Topological molecule polar surface area 46.5

7. Number of heavy atoms: 20

8. Surface charge: 0

9. Complexity: 335

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

basic properties

White powder. Soluble in acetone, insoluble in methanol, insoluble in water.

Storage method

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Synthesis method

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Purpose

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�Chemical Data

1. Reference value for hydrophobic parameter calculation (XlogP): 4.8

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: 3

6. Topological molecule polar surface area 46.5

7. Number of heavy atoms: 20

8. Surface charge: 0

9. Complexity: 335

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

basic properties

White powder. Soluble in acetone, insoluble in methanol, insoluble in water.

Storage method

None yet

Synthesis method

None yet

Purpose

None yet