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1679-47-6 | Dihydro-3-methyl-2(3H)-furanone
CAS No: 1679-47-6 Catalog No: AG0039G1 MDL No:MFCD00005396
Product Description
Catalog Number:
AG0039G1
Chemical Name:
Dihydro-3-methyl-2(3H)-furanone
CAS Number:
1679-47-6
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
MDL Number:
MFCD00005396
IUPAC Name:
3-methyloxolan-2-one
InChI:
InChI=1S/C5H8O2/c1-4-2-3-7-5(4)6/h4H,2-3H2,1H3
InChI Key:
QGLBZNZGBLRJGS-UHFFFAOYSA-N
SMILES:
O=C1OCCC1C
EC Number:
216-846-0
NSC Number:
102837
Properties
Complexity:
88.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.052g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
100.117g/mol
Monoisotopic Mass:
100.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Costunolide inhibits production of tumor necrosis factor-alpha and interleukin-6 by inducing heme oxygenase-1 in RAW264.7 macrophages. | Inflammation research : official journal of the European Histamine Research Society ... [et al.] 20071201 |
| The alpha-methylene-gamma-butyrolactone moiety in dehydrocostus lactone is responsible for cytoprotective heme oxygenase-1 expression through activation of the nuclear factor E2-related factor 2 in HepG2 cells. | European journal of pharmacology 20070622 |
| Effects of natural and chemically synthesized furanones on quorum sensing in Chromobacterium violaceum. | BMC microbiology 20040101 |
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