4-Chlorocinnamaldehyde

Base Information

• Chemical Name: 4-Chlorocinnamaldehyde
• CAS No.: 49678-02-6
• Molecular Formula: C9H7ClO
• Molecular Weight: 166.60
• Hs Code.: 2913000090
• European Community (EC) Number: 663-246-3
• Nikkaji Number: J432.421H,J953.646I
• Mol file: 49678-02-6.mol

Synonyms:49678-02-6;4-CHLOROCINNAMALDEHYDE;(E)-3-(4-Chlorophenyl)acrylaldehyde;1075-77-0;3-(4-Chlorophenyl)acrylaldehyde;p-Chlorocinnamaldehyde;(E)-3-(4-chlorophenyl)prop-2-enal;4-Chloro cinnamaldehyde;3-(4-chlorophenyl)prop-2-enal;(E)-3-(4-Chlorophenyl)-2-propenal;trans-p-Chlorocinnamaldehyde;trans-4-chlorocinnamaldehyde;2-Propenal, 3-(4-chlorophenyl)-, (2E)-;4-Chlorobenzeneacrylaldehyde;4-Chlorocinnamaldehyde, 96%;SCHEMBL431858;AMY3536;HONRSHHPFBMLBT-OWOJBTEDSA-N;BAA07577;CS-D1085;(E)-3-(4-Chloro-phenyl)-propenal;MFCD00156880;AKOS006273607;trans-3-(4-Chlorophenyl)-2-propenal;DS-6010;NCGC00170991-01;PK04_096309;EN300-116409;A871753;J-501913;Z2242062296

Chemical Property of 4-Chlorocinnamaldehyde

Chemical Property:

• Vapor Pressure: 0.00208mmHg at 25°C
• Melting Point: 57-63°C
• Refractive Index: 1.591
• Boiling Point: 290.4 °C at 760 mmHg
• Flash Point: 134.6 °C
• PSA: 17.07000
• Density: 1.192 g/cm³
• LogP: 2.55210
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 166.0185425
• Heavy Atom Count: 11
• Complexity: 146

Purity/Quality:

98%,99%, ^*data from raw suppliers

(E)-3-(4-Chlorophenyl)acrylaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/38-43
• Safety Statements: 26-36/37

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C=CC=O)Cl
• Isomeric SMILES: C1=CC(=CC=C1/C=C/C=O)Cl