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2,2-DIMETHYL-4-(2-NAPHTHYL)-4-OXOBUTYRICACID

2,2-DIMETHYL-4-(2-NAPHTHYL)-4-OXOBUTYRICACID structure

CAS No:
854648-79-6
Formula:
C16H16O3
Chemical Name:
2,2-DIMETHYL-4-(2-NAPHTHYL)-4-OXOBUTYRICACID
Synonyms:
2,2-DIMETHYL-4-(2-NAPHTHYL)-4-OXOBUTYRIC ACID;2-Naphthalenebutanoic acid, α,α-dimethyl-γ-oxo-

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2,2-DIMETHYL-4-(2-NAPHTHYL)-4-OXOBUTYRICACID Basic Attributes

Molecular Weight：

256.3

Exact Mass：

256.109944368

DSSTox ID：

DTXSID80645352

Characteristics

Density：

1.187±0.06 g/cm3

Melting Point：

170 °C

Boiling Point：

459.5±28.0 °C(Predicted)

PKA：

4.61±0.28

Computed Properties

Molecular Weight:256.30
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:256.109944368
Monoisotopic Mass:256.109944368
Topological Polar Surface Area:54.4
Heavy Atom Count:19
Complexity:359
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2-DIMETHYL-4-(2-NAPHTHYL)-4-OXOBUTYRICACID

Basic Attributes
Characteristics
Computed Properties

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