sodium;(E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoate


Chemical Name: sodium;(E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoate
CAS Number: 130952-46-4
Product Number: AG000V5J(AGN-PC-0472BJ)
Synonyms:
MDL No:
Molecular Formula: C13H11N2NaO2
Molecular Weight: 250.2284

Identification/Properties


Computed Properties
Molecular Weight:
250.233g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
250.072g/mol
Monoisotopic Mass:
250.072g/mol
Topological Polar Surface Area:
58A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
289
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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