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Tetrahydro-4,6,6-trimethyl-2H-pyran-2-one

Tetrahydro-4,6,6-trimethyl-2H-pyran-2-one structure

CAS No:
20628-36-8
Formula:
C8H14O2
Chemical Name:
Tetrahydro-4,6,6-trimethyl-2H-pyran-2-one
Synonyms:
2H-Pyran-2-one,tetrahydro-4,6,6-trimethyl-;Hexanoic acid,5-hydroxy-3,5-dimethyl-,δ-lactone;Tetrahydro-4,6,6-trimethyl-2H-pyran-2-one;NSC 134776

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Tetrahydro-4,6,6-trimethyl-2H-pyran-2-one Basic Attributes

Molecular Weight：

142.19600

Exact Mass：

142.20

EC Number：

243-927-8

NSC Number：

134776

HScode：

2932999099

Characteristics

PSA：

26.30000

XLogP3：

1.73810

Density：

0.933g/cm3

Melting Point：

26-28 °C

Boiling Point：

100 °C @ Press: 5 Torr

Flash Point：

79.2ºC

Refractive Index：

1.423

Vapor Pressure：

0.154mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 10 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:142.20
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Exact Mass:142.099379685
Monoisotopic Mass:142.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:149
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Tetrahydro-4,6,6-trimethyl-2H-pyran-2-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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