ChemicalBook--->CAS DataBase List--->823-22-3

823-22-3

823-22-3 Structure

823-22-3 Structure
IdentificationMore
[Name]

delta-Hexalactone
[CAS]

823-22-3
[Synonyms]

5-hydroxyhexanoic acid lactone
5-METHYL-DELTA-VALEROLACTONE
DELTA-CAPROLACONE
DELTA-CAPROLACTONE
DELTA-HEXALACTONE
DELTA-HEXANOLACTONE
delta-Methyl-delta-valerolactone
FEMA 3167
HEXALACTONE, DELTA-
TETRAHYDRO-6-METHYL-2H-PYRAN-2-ONE
<
2H-Pyran-2-one, 6-methyl, tetrahydro
2H-Pyran-2-one, tetrahydro-6-methyl-
5-hexanolide
6-Methyltetrahydro-2H-pyran-2-one
delta>
-Hexalactone
Hexanoic acid, 5-hydroxy-, delta-lactone
Hexanoic acid, 5-hydroxy-, lactone
tetrahydro-6-methyl-2h-pyran-2-on
[EINECS(EC#)]

212-511-8
[Molecular Formula]

C6H10O2
[MDL Number]

MFCD00083574
[Molecular Weight]

114.14
[MOL File]

823-22-3.mol
Chemical PropertiesBack Directory
[Melting point ]

18°C
[Boiling point ]

110-112 °C15 mm Hg(lit.)
[density ]

1.037 g/mL at 25 °C(lit.)
[FEMA ]

3167
[refractive index ]

n20/D 1.452(lit.)
[Fp ]

225 °F
[storage temp. ]

-20°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

lyophilized powder
[color ]

Clear Colourless
[Specific Gravity]

1.04
[Odor]

at 100.00 %. creamy fruity coconut
[biological source]

synthetic
[Odor Type]

herbal
[Water Solubility ]

Immiscible with water.
[JECFA Number]

224
[BRN ]

80501
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C6H10O2/c1-5-3-2-4-6(7)8-5/h5H,2-4H2,1H3
[InChIKey]

RZTOWFMDBDPERY-UHFFFAOYSA-N
[SMILES]

CC1CCCC(=O)O1
[LogP]

0.29
[CAS DataBase Reference]

823-22-3(CAS DataBase Reference)
[NIST Chemistry Reference]

2H-pyran-2-one, tetrahydro-6-methyl-(823-22-3)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H335-H319
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
[Safety Statements ]

22-24/25
[WGK Germany ]

2
[HS Code ]

2932.20.5050
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
Hazard InformationBack Directory
[Description]

Synthesis: By oxidation of 1-substituted cycloalkanes.
[Chemical Properties]

δ-Hexalactone is a relatively weak-flavored chemical. The odor is described as coumarinic with coconut, cream and chocolate notes.
[Occurrence]

Reported found in coconut oil, heated milk fat, butter oil, papaya, raspberry, strawberry fruit and jam, blue cheeses, yogurt, chicken fat, cured pork, green tea, plum, mango, wood apple, soursop and babaco fruit (Carica pentagona Heilborn)
[Uses]

d-Hexanolactone is widely used in butter, cream milk, nut, fruit flavors and in cosmetic flavor.
[Definition]

ChEBI: Delta-Hexanolactone is a delta-lactone.
[Preparation]

By oxidation of 1-substituted cycloalkanes.
Spectrum DetailBack Directory
[Spectrum Detail]

delta-Hexalactone(823-22-3)MS
delta-Hexalactone(823-22-3)1HNMR
delta-Hexalactone(823-22-3)13CNMR
delta-Hexalactone(823-22-3)IR1
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

delta-Hexanolactone, 98%(823-22-3)
[Sigma Aldrich]

823-22-3(sigmaaldrich)
[TCI AMERICA]

delta-Hexanolactone,>97.0%(GC)(823-22-3)
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