N-tert-butyl acrylamide N-tert-Butyl acrylamide

Published by BDMAEE on 2024-01-26 | Permalink

Structural formula

Business number	02VG
Molecular formula	C7H13NO
Molecular weight	127.18
label	N-(1,1-dimethylethyl)-2-acrylamide, N-tert-butylacrylamide, N-Tert-Butylacrylamide, N-Acryloyl-Tert-Butylamine, N-(1,1-Dimethylethyl)-2-Propenamide, CH2=CHCONHC(CH3)3

Numbering system

CAS number:107-58-4

MDL number:MFCD00026271

EINECS number:203-505-6

RTECS number:AS3460000

BRN number:1742331

PubChem number:24865764

Physical property data

1. Properties: white crystalline powder.

2. Density (g/mL, 25℃): Undetermined

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

4. Melting point (ºC): 128-130

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

6. Boiling point (ºC, kPa): Undetermined

7. Refractive index (_D²⁰): Not determined

8. Flash point (ºC): Not determined

8. p>

9. Specific rotation (ºC): Undetermined

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

11. Vapor pressure (mmHg , ºC): Undetermined

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

13. Heat of combustion (KJ/mol): Undetermined

14. Critical temperature (ºC): Undetermined

15. Critical pressure (KPa): Undetermined

16. Log value of oil-water (octanol/water) partition coefficient : Undetermined

17. Explosion upper limit (%, V/V): Undetermined

18. Explosion lower limit (%, V/V): Undetermined

19. Solubility: Undetermined

Toxicological data

1. Acute toxicity: mouse oral LD50: 941mg/kg;

Ecological data

This substance is slightly hazardous to water.

Molecular structure data

1. Molar refractive index: 37.79

2. Molar volume (cm³/mol): 145.1

3. Isotonic specific volume (90.2K ): 327.7

4. Surface tension (dyne/cm): 25.9

5. Polarizability (10-24cm3): 14.98

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 1.1

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 2

5. Number of tautomers: 2

6. Topological molecule polar surface area 29.1

7. Number of heavy atoms: 9

8. Surface charge: 0

9.��Hurility: 121

10. Number of isotope atoms: 0

11. Determined number of atomic stereocenters: 0

12. Uncertain atomic stereocenter Number of stereocenters: 0

13. Determine the number of stereocenters of chemical bonds: 0

14. Uncertain number of stereocenters of chemical bonds: 0

15. Total Number of price key units: 1

Properties and stability

Avoid contact with strong oxidizing agents.

Storage method

Stored in a cool, ventilated warehouse. Keep away from fire and heat sources. The packaging is sealed. should be kept away from oxidizer, do not store together. Equipped with the appropriate variety and quantity of fire equipment. Suitable materials should be available in the storage area to contain spills. The “five pairs” management system for extremely toxic substances should be strictly implemented.

Synthesis method

None

Purpose

None