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2-(1-Acetyl-2-oxopropyl)benzoicacid

2-(1-Acetyl-2-oxopropyl)benzoicacid structure

CAS No:
52962-26-2
Formula:
C12H12O4
Chemical Name:
2-(1-Acetyl-2-oxopropyl)benzoicacid
Synonyms:
2-(1-Acetyl-2-oxopropyl)benzoicacid;Benzoic acid, 2-(1-acetyl-2-oxopropyl)-;2-(1-acetyl-2-keto-propyl)benzoic acid;2-(2,4-dioxopentan-3-yl)benzoic acid

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2-(1-Acetyl-2-oxopropyl)benzoicacid Basic Attributes

Molecular Weight：

220.22128

Exact Mass：

220.07400

DSSTox ID：

DTXSID60373863

HScode：

2918300090

Characteristics

PSA：

71.44000

XLogP3：

1.64640

Density：

1.228±0.06 g/cm3(Predicted)

Melting Point：

140 °C(Solv: ethanol (64-17-5))

Computed Properties

Molecular Weight:220.22
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:220.07355886
Monoisotopic Mass:220.07355886
Topological Polar Surface Area:71.4
Heavy Atom Count:16
Complexity:294
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1-Acetyl-2-oxopropyl)benzoicacid

Basic Attributes
Characteristics
Computed Properties

2-(1-Acetyl-2-oxopropyl)benzoicacid

SDS

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