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5-(4-METHYLPHENYL)CYCLOHEXANE-1,3-DIONE

5-(4-METHYLPHENYL)CYCLOHEXANE-1,3-DIONE structure

CAS No:
61888-37-7
Formula:
C13H14O2
Chemical Name:
5-(4-METHYLPHENYL)CYCLOHEXANE-1,3-DIONE
Synonyms:
HMS550B01; 5-(4-methylphenyl)-cyclohexane-1,3-dione; 5-p-tolyl-cyclohexane-1,3-dione; 5-(4-methylphenyl)-1,3-cyclohexanedione;

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5-(4-METHYLPHENYL)CYCLOHEXANE-1,3-DIONE Basic Attributes

Molecular Weight：

202.24900

Exact Mass：

202.099379685 g/mol

DSSTox ID：

DTXSID20341886

HScode：

2914399090

Characteristics

PSA：

34.14000

XLogP3：

2.40070

Density：

1.124g/cm3

Melting Point：

176-179ºC

Boiling Point：

372.5ºC at 760 mmHg

Flash Point：

139.7ºC

Refractive Index：

1.548

Computed Properties

Molecular Weight:202.25
XLogP3:1.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:202.099379685
Monoisotopic Mass:202.099379685
Topological Polar Surface Area:34.1
Heavy Atom Count:15
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(4-METHYLPHENYL)CYCLOHEXANE-1,3-DIONE

Basic Attributes
Characteristics
Computed Properties

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