2-Cyanoethyl Acrylate 2-Cyanoethyl Acrylate

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:106-71-8

MDL number:None

EINECS number:203-426-7

RTECS number:AT1500000

BRN number:None

PubChem ID:None

Physical property data

1. Skin/eye irritation

Open irritation test: rabbit, skin contact: 500mg, severity of reaction: moderate.

Standard Draize test: Rabbit, skin contact: 10mg/24H, severity of reaction: severe. ​​

Standard Draize test: Rabbit, eye contact: 5 mg, severity of reaction: mild.

2. Acute toxicity: rat oral LD50: 180mg/kg; rabbit skin contact LD50: 220μL/kg;

Toxicological data

1. Irritation: Rabbit transdermal: open irritation test, 500mg, moderate irritation. Rabbit eye: 5mg, mild irritation.

2. Acute toxicity: Rat oral LD5O: 180mg/kg

Rabbit skin LD5O: 220mg/kg

Ecological data

This substance may be harmful to the environment and it is recommended not to let it enter the environment.

Molecular structure data

1. Molar refractive index: 31.25

2. Molar volume (cm³/mol): 119.5

3. Isotonic specific volume (90.2K ): 292.8

4. Surface tension (dyne/cm): 36.0

5. Polarizability (10-24cm3): 12.39

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: none

6. Topological molecule polar surface area 50.1

7. Number of heavy atoms: 9

8. Surface charge: 0

9. Complexity: 154

10. Number of isotope atoms: 0

11. Determine atomsNumber of stereocenters: 0

12. Uncertain number of stereocenters of atoms: 0

13. Determined number of stereocenters of chemical bonds: 0

14. Uncertain number of stereocenters of chemical bonds: 0

15. Number of covalent bond units: 1

Properties and stability

Avoid contact with strong oxidants, strong acids, and strong alkali.

Storage method

Stored in a cool, ventilated warehouse. Keep away from fire and heat sources. Protect from direct sunlight. Keep container sealed and strictly prohibited from contact with air. They should be stored separately from oxidants, acids, alkalis, and food chemicals, and avoid mixed storage. Equipped with the appropriate variety and quantity of fire equipment. The storage area should be equipped with emergency release equipment and suitable containment materials.

Synthesis method

None yet

Purpose

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