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Home > Encyclopedia > BETA-OXO-BENZENEPENTANOIC ACID 1,1-DIMETHYLETHYL ESTER

BETA-OXO-BENZENEPENTANOIC ACID 1,1-DIMETHYLETHYL ESTER

BETA-OXO-BENZENEPENTANOIC ACID 1,1-DIMETHYLETHYL ESTER structure

BETA-OXO-BENZENEPENTANOIC ACID 1,1-DIMETHYLETHYL ESTER 

structure
  • CAS No:

    95679-57-5

  • Formula:

    C15H20O3

  • Chemical Name:

    BETA-OXO-BENZENEPENTANOIC ACID 1,1-DIMETHYLETHYL ESTER

  • Synonyms:

    tert-butyl 3-oxo-5-phenylpentanoate;SCHEMBL7058420;ZINC140789877;DA-00193;FT-0706405;3-Oxo-5-phenylpentanoic acid tert-butyl ester

BETA-OXO-BENZENEPENTANOIC ACID 1,1-DIMETHYLETHYL ESTER Basic Attributes

248.32

248.141

Characteristics

43.4

2.8

Computed Properties

Molecular Weight:248.32
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:248.14124450
Monoisotopic Mass:248.14124450
Topological Polar Surface Area:43.4
Heavy Atom Count:18
Complexity:283
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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