Benzenepropanoic acid, 4-(1,1-dimethylethyl)-, methyl ester


Chemical Name: Benzenepropanoic acid, 4-(1,1-dimethylethyl)-, methyl ester
CAS Number: 1211-99-0
Product Number: AG007P4F(AGN-PC-03KNNM)
Synonyms:
MDL No:
Molecular Formula: C14H20O2
Molecular Weight: 220.3074

Identification/Properties


Computed Properties
Molecular Weight:
220.312g/mol
XLogP3:
4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
5
Exact Mass:
220.146g/mol
Monoisotopic Mass:
220.146g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
219
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

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NMR Spectrum


Other Analytical Data


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