α-Hydroxy-γ-butyrolactone - CAS 19444-84-9

Catalog:	BB015063
Product Name:	α-Hydroxy-γ-butyrolactone
CAS:	19444-84-9
Synonyms:	3-hydroxyoxolan-2-one

Technical Data

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Computed Properties

IUPAC Name:	3-hydroxyoxolan-2-one
Description:	α-Hydroxy-γ-butyrolactone can be used for catalyst composition for olefin polymerization for various applications. It can also be used for herbicidal agents.
Molecular Weight:	102.09
Molecular Formula:	C4H6O3
Canonical SMILES:	C1COC(=O)C1O
InChI:	InChI=1S/C4H6O3/c5-3-1-2-7-4(3)6/h3,5H,1-2H2
InChI Key:	FWIBCWKHNZBDLS-UHFFFAOYSA-N
Density:	1.309 g/cm³
Appearance:	Viscous colorless to yellow liquid
MDL:	MFCD00134268
LogP:	-0.70580

Publication Number	Title	Priority Date
CN-112876394-A	Preparation method of DL-hydroxyselenomethionine	20210209
CN-112939901-A	Preparation method of alpha-hydroxy-gamma-butyrolactone	20210209
CN-112796145-A	Moss scented cigarette paper, its preparation method and use	20210202
CN-112641706-A	Shampoo containing compound bamboo juice	20210115
CN-112704657-A	Shampoo containing bamboo extract compound preparation	20210115

PMID	Publication Date	Title	Journal
17530243	20070701	Isolation and properties of a levo-lactonase from Fusarium proliferatum ECU2002: a robust biocatalyst for production of chiral lactones	Applied microbiology and biotechnology
16531650	20060101	Negative electrospray, ion trap multistage mass spectrometry of synthetic fragments of the O-PS of Vibrio cholerae O:1	European journal of mass spectrometry (Chichester, England)
17057281	20060101	Positive-ion fragmentation in matrix-assisted laser desorption/ionization tandem time of flight mass spectrometry of synthetic analogs of the O-specific polysaccharide of Vibrio cholerae O:1	European journal of mass spectrometry (Chichester, England)

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	88.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	102.031694049
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	102.031694049
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4