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3-Heptyltetrahydro-2H-pyran-2-one

3-Heptyltetrahydro-2H-pyran-2-one structure

CAS No:
59726-51-1
Formula:
C12H22O2
Chemical Name:
3-Heptyltetrahydro-2H-pyran-2-one
Synonyms:
2H-Pyran-2-one,3-heptyltetrahydro-;3-Heptyltetrahydro-2H-pyran-2-one;α-Heptyl-δ-valerolactone

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3-Heptyltetrahydro-2H-pyran-2-one Basic Attributes

Molecular Weight：

198.30 g/mol

Exact Mass：

198.30

EC Number：

261-889-0

Characteristics

PSA：

26.3 Å²

Boiling Point：

134-136 °C @ Press: 4 Torr

Computed Properties

Molecular Weight:198.30
XLogP3:4.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:198.161979940
Monoisotopic Mass:198.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:166
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Heptyltetrahydro-2H-pyran-2-one

Basic Attributes
Characteristics
Computed Properties

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