methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate


Chemical Name: methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate
CAS Number: 26165-66-2
Product Number: AG002RYJ(AGN-PC-0JVPDY)
Synonyms:
MDL No:
Molecular Formula: C14H15NO2
Molecular Weight: 229.2744

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
229.279g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
229.11g/mol
Monoisotopic Mass:
229.11g/mol
Topological Polar Surface Area:
31.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
261
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
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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