2-Propenoic acid, 2-cyano-3-(4-hydroxyphenyl)-


Chemical Name: 2-Propenoic acid, 2-cyano-3-(4-hydroxyphenyl)-
CAS Number: 28166-41-8
Product Number: AG00BCDB(AGN-PC-0JK64C)
Synonyms:
MDL No:
Molecular Formula: C10H7NO3
Molecular Weight: 189.16748

Identification/Properties


Properties
MP:
245-250 °C(lit.)
BP:
398.1°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.5400 (estimate)
Solubility:
methanol: 10 mg/mL, clear
Computed Properties
Molecular Weight:
189.17g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
189.043g/mol
Monoisotopic Mass:
189.043g/mol
Topological Polar Surface Area:
81.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
292
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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