2-Propenal, 3-phenyl-


Chemical Name: 2-Propenal, 3-phenyl-
CAS Number: 104-55-2
Product Number: AG00HA96(AGN-PC-0JK5JO)
Synonyms:
MDL No:
Molecular Formula: C9H8O
Molecular Weight: 132.15922

Identification/Properties


Properties
MP:
-9 - -4 °C
BP:
246.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
n20/D 1.622(lit.)
Solubility:
1g/l soluble
Computed Properties
Molecular Weight:
132.162g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
132.058g/mol
Monoisotopic Mass:
132.058g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
121
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H317-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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