Benzeneacetic acid, a-cyclopentyl-a-hydroxy-, methyl ester


Chemical Name: Benzeneacetic acid, a-cyclopentyl-a-hydroxy-, methyl ester
CAS Number: 19833-96-6
Product Number: AG002BFG(AGN-PC-0QPROO)
Synonyms:
MDL No:
Molecular Formula: C14H18O3
Molecular Weight: 234.2909

Identification/Properties


Computed Properties
Molecular Weight:
234.295g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
234.126g/mol
Monoisotopic Mass:
234.126g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
265
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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


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