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4-ethyl-5-hydroxy-2,2-dimethylcyclopent-4-ene-1,3-dione

4-ethyl-5-hydroxy-2,2-dimethylcyclopent-4-ene-1,3-dione structure

CAS No:
79700-00-8
Formula:
C9H12O3
Chemical Name:
4-ethyl-5-hydroxy-2,2-dimethylcyclopent-4-ene-1,3-dione
Synonyms:
79700-00-8;NSC353873;4-ethyl-5-hydroxy-2,2-dimethylcyclopent-4-ene-1,3-dione;DTXSID70320025;ZINC5478808;NSC-353873

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4-ethyl-5-hydroxy-2,2-dimethylcyclopent-4-ene-1,3-dione Basic Attributes

Molecular Weight：

168.19 g/mol

Exact Mass：

168.078644241 g/mol

NSC Number：

353873

DSSTox ID：

DTXSID70320025

Characteristics

PSA：

54.4 Å²

Computed Properties

Molecular Weight:168.19
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:168.078644241
Monoisotopic Mass:168.078644241
Topological Polar Surface Area:54.4
Heavy Atom Count:12
Complexity:284
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-ethyl-5-hydroxy-2,2-dimethylcyclopent-4-ene-1,3-dione

Basic Attributes
Characteristics
Computed Properties

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