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1-phenylhexane-1,3-dione

1-phenylhexane-1,3-dione structure

CAS No:
5331-13-5
Formula:
C12H14O2
Chemical Name:
1-phenylhexane-1,3-dione
Synonyms:
1-phenylhexane-1,3-dione;1-PHENYL-1,3-HEXANEDIONE;5331-13-5;Butyrylacetophenon;NSC2250;SCHEMBL3163311;DTXSID30277405;NSC-2250;ZINC4353334;AKOS010652636

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1-phenylhexane-1,3-dione Basic Attributes

Molecular Weight：

190.24 g/mol

Exact Mass：

190.099379685 g/mol

NSC Number：

2250

DSSTox ID：

DTXSID30277405

Characteristics

PSA：

34.1 Å²

Computed Properties

Molecular Weight:190.24
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:190.099379685
Monoisotopic Mass:190.099379685
Topological Polar Surface Area:34.1
Heavy Atom Count:14
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-phenylhexane-1,3-dione

Basic Attributes
Characteristics
Computed Properties

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