2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, ethyl ester


Chemical Name: 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, ethyl ester
CAS Number: 4046-02-0
Product Number: AG003LHZ(AGN-PC-0JL6KF)
Synonyms:
MDL No:
Molecular Formula: C12H14O4
Molecular Weight: 222.2372

Identification/Properties


Properties
MP:
63-65 °C(lit.)
BP:
382.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Stability:
Light Sensitive
Refractive Index:
1.4560 (estimate)
Computed Properties
Molecular Weight:
222.24g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
222.089g/mol
Monoisotopic Mass:
222.089g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
249
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-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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