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3-Pentyl-2,4-pentanedione

3-Pentyl-2,4-pentanedione structure

CAS No:
27970-50-9
Formula:
C10H18O2
Chemical Name:
3-Pentyl-2,4-pentanedione
Synonyms:
2,4-Pentanedione,3-pentyl-;3-Pentyl-2,4-pentanedione;3-Amyl-2,4-pentanedione;NSC 87949

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3-Pentyl-2,4-pentanedione Basic Attributes

Molecular Weight：

170.24900

Exact Mass：

170.25

EC Number：

248-754-1

NSC Number：

87949

DSSTox ID：

DTXSID10182245

Characteristics

PSA：

34.14000

XLogP3：

2.36090

Density：

0.904g/cm3

Boiling Point：

237.7ºC

Flash Point：

86.8ºC

Refractive Index：

1.427

Vapor Pressure：

0.0442mmHg at 25°C

Safety Information

safety instructions：

S24/25

Marks：

Computed Properties

Molecular Weight:170.25
XLogP3:2.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:170.130679813
Monoisotopic Mass:170.130679813
Topological Polar Surface Area:34.1
Heavy Atom Count:12
Complexity:147
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Pentyl-2,4-pentanedione

Basic Attributes
Characteristics
Safety Information
Computed Properties

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