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5-Methyl-1-phenyl-1,3-hexanedione

5-Methyl-1-phenyl-1,3-hexanedione structure

CAS No:
13893-97-5
Formula:
C13H16O2
Chemical Name:
5-Methyl-1-phenyl-1,3-hexanedione
Synonyms:
1,3-Hexanedione,5-methyl-1-phenyl-;5-Methyl-1-phenyl-1,3-hexanedione;1-Isobutyl-3-phenyl-1,3-propanedione;Benzoylisovaleroylmethane;Rhodiastab 82;1-Phenyl-5-methylhexane-1,3-dione;1-Benzoyl-4-methyl-2-pentanone;Isopentanoylbenzoylmethane

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5-Methyl-1-phenyl-1,3-hexanedione Basic Attributes

Molecular Weight：

204.26 g/mol

Exact Mass：

204.26

EC Number：

237-661-1

DSSTox ID：

DTXSID70160847

Characteristics

PSA：

34.1 Å²

Density：

1.031 g/cm³ @ Temp: 20 °C

Boiling Point：

160-161 °C @ Press: 11 Torr

Computed Properties

Molecular Weight:204.26
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:204.115029749
Monoisotopic Mass:204.115029749
Topological Polar Surface Area:34.1
Heavy Atom Count:15
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Methyl-1-phenyl-1,3-hexanedione

Basic Attributes
Characteristics
Computed Properties

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