Toluene diisocyanate manufacturer Knowledge Benzyl 4-Hydroxybenzoate

Benzyl 4-Hydroxybenzoate

Benzyl 4-Hydroxybenzoate

Structural formula

Business number 027C
Molecular formula C14H12O3
Molecular weight 228.24
label Benzylparaben, Benzylparaben, Phenylmethyl 4-Hydroxybenzoate, Benzyl ortho-hydroxybenzoate, Benzyl 4-Hydroxybenzoate, 4-Hydroxy-benzoicaciphenylmethylester

Numbering system

CAS number:94-18-8

MDL number:MFCD00016471

EINECS number:202-311-9

RTECS number:DH2691000

BRN number:2115995

PubChem number:24878916

Physical property data

1. Character:White powder.

2. Density (g/mL,25/4): Undetermined

3. Relative vapor density (g/mL,AIR=1): Undetermined

4. Melting point (ºC):110112

5. Boiling point (ºC,Normal pressure): Undetermined

6. Boiling point (ºC,5.2kPa): Undetermined

7. Refractive index: Undetermined

8. Flashpoint (ºC): Undetermined

9. Specific rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC): Undetermined

11. Vapor pressure (kPa,25ºC): Undetermined

12. Saturated vapor pressure (kPa,60ºC): Undetermined

18. Lower explosion limit (%,V/V): Undetermined

19. Solubility:Easily soluble in ethanol, soluble in ether, insoluble in water.

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

1. Molar refractive index:64.39

2. Molar volume (m3/mol):186.4

3. Isotonic specific volume (90.2K): 499.2

4. Surface tension (dyne/cm): 51.4

5. Polarizability10-24cm3):25.52

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: 3

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: 4

6. Topological molecule polar surface area 46.5

7. Number of heavy atoms: 17

8. Surface charge: 0

9. Complexity: 238

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

This product should be kept sealed.

Synthesis method

None yet

Purpose

Fragrance synthesis.

t-family: Arial; mso-bidi-font-family: Arial">Surface tension (dyne/cm):51.4

5. Polarizability10-24cm3):25.52

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: 3

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: 4

6. Topological molecule polar surface area 46.5

7. Number of heavy atoms: 17

8. Surface charge: 0

9. Complexity: 238

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

This product should be kept sealed.

Synthesis method

None yet

Purpose

Fragrance synthesis.

This article is from the Internet, does not represent the position of Toluene diisocyanate reproduced please specify the source.https://www.chemicalchem.com/archives/28427

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