Results for:
PubChem ID: 7302

Oxolan-2-one

Mass-Spectra

Compound Details

Synonymous names
gamma-Butyrolactone
96-48-0
dihydrofuran-2(3H)-one
BUTYROLACTONE
4-Butyrolactone
4-Butanolide
1,4-Butanolide
2-Oxolanone
4-Hydroxybutyric acid lactone
4-Deoxytetronic acid
Butyrylactone
2(3H)-Furanone, dihydro-
Dihydro-2(3H)-furanone
1,2-Butanolide
Butyryl lactone
Butyric acid lactone
oxolan-2-one
Tetrahydro-2-furanone
BLON
gamma-BL
4-Hydroxybutanoic acid lactone
Dihydro-2-furanone
g-Butyrolactone
1,4-Lactone
Agrisynth BLO
gamma-Hydroxybutyric acid lactone
gamma-Hydroxybutyrolactone
2-Oxotetrahydrofuran
.gamma.-Butyrolactone
NCI-C55878
gamma-6480
gama-Butyrolactone
GBL
FEMA No. 3291
1-Oxacyclopentan-2-one
gamma Butyrolactone
NSC 4592
gamma-Butanolactone
gamma-Butyrolactone-13C4
gamma-Hydroxybutyric Acid cyclic ester
1,4-Butyrolactone
.gamma.-BL
Butyric acid, 4-hydroxy-, gamma-lactone
.gamma.-6480
BLO
.gamma.-Hydroxybutyrolactone
OL659KIY4X
DTXSID6020224
CHEBI:42639
.gamma.-Hydroxybutyric acid lactone
NSC-4592
4-Hydroxybutyric acid, .gamma.-lactone
.gamma.-Hydroxybutyric acid cyclic ester
4-Hydroxybutanoic acid, .gamma.-lactone
Gammabutyrolactone (GBL)
DTXCID80224
No Go
Caswell No. 132B
gamma-Butalactone
gamma-butyrolacton
Paint Clean G
CAS-96-48-0
31213-03-3
gamma-Butyryllactone
gamma-Butyrolactone (natural)
CCRIS 2924
gamma-Butyrolactone; GBL; Gammabutyrolactone
tetrahydrofuran-2-one
HSDB 4290
EINECS 202-509-5
UNII-OL659KIY4X
EPA Pesticide Chemical Code 122303
Revivarant
Remforce
4 Hydroxybutyric Acid Lactone
Butanoic acid, 4-hydroxy-, gamma-lactone
g-Butalactone
4-butanolactone
AI3-28121
g-Butyryllactone
GH Revitalizer
Blue Nitro
gammabutyrolactone
tetrahydrofuranone
4-Deoxytetronate
C-1070
Dihyro-2-furanone
dihydrofuran-2-one
gamma-butyro-lactone
NIH 10540
dihydro-furan-2-one
.alpha.-Butyrolactone
.gamma.-Butanolactone
2(3H)-dihydrofuranone
1-Oxacyclopentane-2-one
WLN: T5OVTJ
BUTYROLACTONE [MI]
EC 202-509-5
BUTYROLACTONE [INCI]
BUTYROLACTONE [VANDF]
Dynasolve 699 (Salt/Mix)
g-Hydroxybutyric acid lactone
CHEMBL95681
Dihydro-(3 H)-furan-2-one
Butyric acid, .gamma.-lactone
BUTYROLACTONE [WHO-DD]
GTPL5462
Butanoic acid, .gamma.-lactone
4,5-Dihydro-2(3H)-furanone
GAMMA-BUTYROLACTONE [FCC]
NSC4592
2,3,4,5-Tetrahydro-2-furanone
4-hydroxy-Butanoic acid g-lactone
GAMMA-BUTYROLACTONE [HSDB]
GAMMA-BUTYROLACTONE [IARC]
Gamma-Lactone 4-hydroxybutyric acid
.gamma.-Hydrooxybutyric acid lactone
gamma-Butyrolactone, >=99% (GC)
Tox21_200490
Tox21_300188
Gamma-Lactone 4-hydroxy-butyric acid
Gamma-Lactone 4-hydroxybutanoic acid
LBG 11785
LMFA07040004
MFCD00005386
STL281877
.GAMMA.-BUTYROLACTONE [FHFI]
AKOS000119924
Gamma-Lactone 4-hydroxy-butanoic acid
DB04699
MCULE-6795890265
gamma-Butyrolactone, analytical standard
NCGC00247920-01
NCGC00247920-02
NCGC00253913-01
NCGC00258044-01
Butyric acid, 4-hydroxy-, .gamma.-lactone
A4867
B0767
Butanoic acid, 4-hydroxy-, .gamma.-lactone
NS00003450
gamma-Butyrolactone, ReagentPlus(R), >=99%
C01770
gamma-Butyrolactone, puriss., >=99.0% (GC)
Q79739
gamma-Butyrolactone, SAJ first grade, >=99.5%
4-Hydroxybutanoic acid lactone, >=98%, FCC, FG
GBL (gamma-Butyrolactone), 10mg/ml in Acetonitrile
GBL (gamma-Butyrolactone), 1mg/ml in Acetonitrile
GBL (gamma-Butyrolactone), 50mg/ml in Acetonitrile
J-513020
J-520327
Q-200482
gamma-Butyrolactone (GBL) 1.0 mg/ml in Acetonitrile
GBL (gamma-Butyrolactone), 100mg/ml in Acetonitrile
InChI=1/C4H6O2/c5-4-2-1-3-6-4/h1-3H
BUTANOIC ACID,4-HYDROXY,LACTONE GAMMA-BUTYROLACTONE
BL
Microorganism:

Yes

IUPAC nameoxolan-2-one
SMILESC1CC(=O)OC1
InchiInChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2
FormulaC4H6O2
PubChem ID7302
Molweight86.09
LogP-0.6
Atoms6
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationesters lactones
CHEBI-ID42639
Supernatural-IDSN0448137

mVOC Specific Details

Boiling Point
DegreeReference
204 °C peer reviewed
Volatilization
The Henry's Law constant for butyrolactone is estimated as 5.3X10-8 atm-cu m/mole(SRC) derived from its vapor pressure, 0.45 mm Hg(1), and assigned value for water solubility of 1X10+6 mg/L (miscible)(2). This Henry's Law constant indicates that butyrolactone is expected to be essentially nonvolatile from water surfaces(3). Butyrolactone's estimated Henry's Law constant indicates that volatilization from moist soil surfaces is not likely to occur(SRC). Butyrolactone is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure of 0.45 mm Hg(1).
Literature: (1) Yaws CL; Handbook of Chemical Compound Data for Process Safety p. 35 (1997) (2) O'Neil MJ, ed; The Merck Index. 14th ed. Whitehouse Station, NJ: Merck and Co., Inc. pp. 259-60 (2006) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
The Koc of butyrolactone is estimated as 11(SRC), using a log Kow of -0.64(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that butyrolactone is expected to have very high mobility in soil.
Literature: (1) Hansch C et al; Exploring QSAR: Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 9 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc p. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
4.5X10-1 mm Hg at 25 deg CYaws CL; Handbook of Chemical Compound Data for Process Safety p. 35 (1997)
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaCandida AlbicansNANAFitzgerald et al. 2022
ProkaryotaStaphylococcus AureusNANAFitzgerald et al. 2021
ProkaryotaEscherichia ColiNANADevaraj et al. 2018
EukaryotaTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
ProkaryotaSalinispora Tropicanamarine sedimentGroenhagen et al. 2016
ProkaryotaStigmatella Sp.n/aNASchulz and Dickschat 2007
ProkaryotaLoktanella Sp.n/aNASchulz and Dickschat 2007
ProkaryotaDinoroseobacter Sp.n/aNASchulz and Dickschat 2007
ProkaryotaStigmatella Aurantiacan/aNADickschat et al. 2005_5
ProkaryotaXanthomonas CampestrisDiffusible factor (DF) regulates the production of pigments (xanthomonadins) and extracellular polysaccarides.NARyan and Dow 2008
ProkaryotaStreptomyces Sp.Diffusible factor (DF) regulates the production of pigments (xanthomonadins) and extracellular polysaccarides.NARyan and Dow 2008
EukaryotaFusarium Graminearumn/aNABusko et al. 2014
EukaryotaFusarium GraminearumNABusko et al. 2014
EukaryotaPhytophthora CinnamomiN/APhytophthora cinnamomiQiu R et al. 2014
Lentinula EdodesGeng et al. 2024
Aspergillus FlavusKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaCandida AlbicansTSBSPME/GC-MSno
ProkaryotaStaphylococcus AureusLBSPME/GC-MSno
ProkaryotaEscherichia ColiTSATD/GC-MSno
EukaryotaTuber Aestivumn/an/ano
EukaryotaTuber Melanosporumn/an/ano
ProkaryotaSalinispora Tropicaseawater-based A1GC/MSno
ProkaryotaStigmatella Sp.n/an/ano
ProkaryotaLoktanella Sp.n/an/ano
ProkaryotaDinoroseobacter Sp.n/an/ano
ProkaryotaStigmatella Aurantiacan/an/ano
ProkaryotaXanthomonas Campestrisn/an/ano
ProkaryotaStreptomyces Sp.n/an/ano
EukaryotaFusarium Graminearumyeast extract sucrose agarSPME/GC-MSno
EukaryotaFusarium Graminearumno
EukaryotaPhytophthora CinnamomiPotato Dextrose Agar,V8 juice agarSPME/GC-MS/MSno
Lentinula EdodesJiuqu (traditional wheat Qu)GC-IMSno
Aspergillus Flavusinoculated potato samplesGC-MSno