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1-(2-hydroxyphenyl)butane-1,3-dione

1-(2-hydroxyphenyl)butane-1,3-dione structure

CAS No:
16636-62-7
Formula:
C10H10O3
Chemical Name:
1-(2-hydroxyphenyl)butane-1,3-dione
Synonyms:
o-Hydroxybenzoylacetone; o-Acetoacetylphenol;

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1-(2-hydroxyphenyl)butane-1,3-dione Basic Attributes

Molecular Weight：

178.18500

Exact Mass：

178.062994177 g/mol

DSSTox ID：

DTXSID00168093

HScode：

2914501900

Characteristics

PSA：

54.37000

XLogP3：

1.55400

Density：

1.191 g/cm3

Boiling Point：

295.1ºC at 760 mmHg

Flash Point：

146.5ºC

Refractive Index：

1.547

Vapor Pressure：

0.000884mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

Computed Properties

Molecular Weight:178.18
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:178.062994177
Monoisotopic Mass:178.062994177
Topological Polar Surface Area:54.4
Heavy Atom Count:13
Complexity:210
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-hydroxyphenyl)butane-1,3-dione

Basic Attributes
Characteristics
Safety Information
Computed Properties

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