2-Propenoic acid, 2-cyano-3-phenyl-, methyl ester, (2E)-


Chemical Name: 2-Propenoic acid, 2-cyano-3-phenyl-, methyl ester, (2E)-
CAS Number: 14533-86-9
Product Number: AG001KT5(AGN-PC-0O32Y3)
Synonyms:
MDL No: MFCD00025864
Molecular Formula: C11H9NO2
Molecular Weight: 187.1947

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
187.198g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
187.063g/mol
Monoisotopic Mass:
187.063g/mol
Topological Polar Surface Area:
50.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
279
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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