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4,6,6-Trimethyl-2-heptanone

4,6,6-Trimethyl-2-heptanone structure

CAS No:
40239-01-8
Formula:
C10H20O
Chemical Name:
4,6,6-Trimethyl-2-heptanone
Synonyms:
2-Heptanone,4,6,6-trimethyl-;4,6,6-Trimethyl-2-heptanone;2,2,4-Trimethylheptan-6-one

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4,6,6-Trimethyl-2-heptanone Basic Attributes

Molecular Weight：

156.269

Exact Mass：

156.27

EC Number：

254-853-0

HScode：

2914190090

Characteristics

PSA：

17.1

XLogP3：

2.9

Density：

0.826 g/cm³ @ Temp: 15.5 °C

Boiling Point：

88.5-89.5 °C @ Press: 37.5 Torr

Flash Point：

46.8ºC

Refractive Index：

1.419

Computed Properties

Molecular Weight:156.26
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:156.151415257
Monoisotopic Mass:156.151415257
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:130
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,6,6-Trimethyl-2-heptanone

Basic Attributes
Characteristics
Computed Properties

4,6,6-Trimethyl-2-heptanone

SDS

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