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3-Methyl-3-hepten-2-one

3-Methyl-3-hepten-2-one structure

CAS No:
39899-08-6
Formula:
C8H14O
Chemical Name:
3-Methyl-3-hepten-2-one
Synonyms:
3-Hepten-2-one,3-methyl-;3-Methyl-3-hepten-2-one

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3-Methyl-3-hepten-2-one Basic Attributes

Molecular Weight：

126.19600

Exact Mass：

126.20

Characteristics

PSA：

17.07000

XLogP3：

2.32180

Density：

0.8555 g/cm³ @ Temp: 20 °C

Boiling Point：

68-69 °C

Flash Point：

59.9ºC

Refractive Index：

1.43

Computed Properties

Molecular Weight:126.20
XLogP3:2.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:126.104465066
Monoisotopic Mass:126.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:123
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Methyl-3-hepten-2-one

Basic Attributes
Characteristics
Computed Properties

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