3-Ethylaniline

3-ethylaniline structural formula

Structural formula

Business number 05YZ
Molecular formula C8H11N
Molecular weight 121
label

m-Ethylaniline,

m-Ethylaniline,

Amines and anilines,

Amines and anilines,

Nitrogen-containing compounds

Numbering system

CAS number:587-02-0

MDL number:MFCD00007818

EINECS number:209-594-8

RTECS number:BX9770000

BRN number:636282

PubChem number:24850503

Physical property data

1. Melting point (ºC): -64

2. Boiling point (ºC, normal pressure): 212, 94ºC (0.8kpa)

3. Density (d254) : 0.9896

4. Refractive index (n20/D): 1.555(lit.)

5. Flash point (ºC): 85

6. Solubility: soluble in ethanol and ether.

Toxicological data

None

Ecological data

None

Molecular structure data

Molecular property data:

1. Molar refractive index: 40.03

2. Molar volume (cm3/mol): 124.5

3. etc. Zhangratong (90.2K): 309.7

4. Surface tension (dyne/cm): 38.2

5. Polarizability (10-24cm3): 15.87

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: 1

4. Number of rotatable chemical bonds: 1

5. Number of tautomers: none

6. Topological molecule polar surface area 26

7. Number of heavy atoms: 9

8. Surface charge: 0

9. Complexity: 80.6

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

1. Exist in smoke.

Storage method

None

Synthesis method

None

Purpose

None

This article is from the Internet, does not represent the position of Toluene diisocyanate reproduced please specify the source.https://www.allhdi.com/archives/47916

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