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3,3-Dimethyl-2,4-pentanedione

3,3-Dimethyl-2,4-pentanedione structure

CAS No:
3142-58-3
Formula:
C7H12O2
Chemical Name:
3,3-Dimethyl-2,4-pentanedione
Synonyms:
2,4-Pentanedione,3,3-dimethyl-;3,3-Dimethyl-2,4-pentanedione;3,3-Dimethylacetylacetone;NSC 42609

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3,3-Dimethyl-2,4-pentanedione Basic Attributes

Molecular Weight：

128.16900

Exact Mass：

128.17

EC Number：

221-551-5

NSC Number：

42609

DSSTox ID：

DTXSID20185348

HScode：

2914190090

Characteristics

PSA：

34.14000

XLogP3：

1.19060

Density：

0.9577 g/cm³ @ Temp: 20 °C

Melting Point：

19 °C

Boiling Point：

173 °C

Flash Point：

57ºC

Refractive Index：

n20/D 1.4290(lit.)

Safety Information

wgk germany：

Computed Properties

Molecular Weight:128.17
XLogP3:0.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:128.083729621
Monoisotopic Mass:128.083729621
Topological Polar Surface Area:34.1
Heavy Atom Count:9
Complexity:129
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-Dimethyl-2,4-pentanedione

Basic Attributes
Characteristics
Safety Information
Computed Properties

3,3-Dimethyl-2,4-pentanedione

SDS

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