2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-


Chemical Name: 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-
CAS Number: 90-50-6
Product Number: AG003IF2(AGN-PC-0JK7VE)
Synonyms:
MDL No:
Molecular Formula: C12H14O5
Molecular Weight: 238.2366

Identification/Properties


Properties
MP:
125-127 °C(lit.)
BP:
300.83°C (rough estimate)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4571 (estimate)
Computed Properties
Molecular Weight:
238.239g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
238.084g/mol
Monoisotopic Mass:
238.084g/mol
Topological Polar Surface Area:
65A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
262
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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