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| CAS Number | 3658-77-3 |
| Catalog Number | AG003LHF(AGN-PC-04692X) |
| Chemical Name | Furaneol |
| EC Number | 222-908-8 |
| FEMA Number | 3174 |
| IUPAC Name | 4-hydroxy-2,5-dimethylfuran-3-one |
| InChI | InChI=1S/C6H8O3/c1-3-5(7)6(8)4(2)9-3/h3,8H,1-2H3 |
| InChI Key | INAXVXBDKKUCGI-UHFFFAOYSA-N |
| MDL Number | MFCD00010706 |
| Molecular Formula | C6H8O3 |
| Molecular Weight | 128.1259 |
| SMILES | O=C1C(C)OC(C)=C1O |
| Synonyms | 2,5-dimethyl-4-hydroxy-3(2H)-furanone,
4-HDMF,
4-hydroxy-2,5-dimethyl-3(2H)-furanone,
alletone,
furaneol,
furaneol, (R)-isomer,
furaneol, (S)-isomer,
3658-77-3,
Furaneol,
4-hydroxy-2,5-dimethylfuran-3(2H)-one,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone,
2,5-Dimethyl-4-hydroxy-3(2H)-furanone,
4-Hydroxy-2,5-dimethyl-3(2H)furanone,
Pineapple ketone,
Alletone,
Dimethylhydroxy furanone,
3(2H)-Furanone, 4-hydroxy-2,5-dimethyl-,
4-hydroxy-2,5-dimethyl-3-furanone,
Strawberry furanone,
Coe 536,
FEMA 3174,
2,5-Dimethyl-4-hydroxy-2,3-dihydrofuran-3-one,
4-hydroxy-2,5-dimethylfuran-3-one,
2,5-Dimethyl-3-hydroxy-4-oxo-4,5-dihydrofuran,
FEMA No. 3174,
EINECS 222-908-8,
4-hydroxy-2,5-dimethyl-2,3-dihydrofuran-3-one,
BRN 1281357,
4-Hydroxy-2,5-dimethylfuran-2(3H)-one,
CHEBI:76247,
INAXVXBDKKUCGI-UHFFFAOYSA-N,
3(2H)-FURANONE, 2,5-DIMETHYL-4-HYDROXY-,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone (natural),
4-hydroxy-2,5-dimethyl-2-hydrofuran-3-one,
CCRIS 8102,
Furaneol Natural,
Nat. Furaneol,
Furaneol,Synthetic,
131222-81-6,
131222-82-7,
ACMC-20mtzz,
PubChem6962,
(+/-)-Furaneol,
AC1L2DVZ,
3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, (2R)-,
3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, (2S)-,
ACMC-1CK6Y,
ACMC-20mu00,
strawberry furanone solution,
DSSTox_CID_21517,
DSSTox_RID_79761,
DSSTox_GSID_41517,
SCHEMBL57008,
KSC222E5L,
Jsp006509,
CHEMBL3186302,
DTXSID0041517,
CTK1C2255,
HSDB 8322,
KS-00000O4U,
Tox21_300823,
ANW-28443,
MFCD00010706,
SBB058632,
4-hydroxy-2,5-dimethyl-furan-3-one,
2,5-dimethyl-4-oxidanyl-furan-3-one,
AKOS015900499,
ACN-051070,
LS-2407,
MCULE-3813239281,
NE10690,
RTR-014967,
VZ29158,
NCGC00248185-01,
NCGC00254727-01,
2,5-dimethyl-4-hydroxy-3[2H] furanone,
4-hydroxy-2,5-dimethyl-3-oxo-2H-furan,
AC-14027,
AK109077,
AN-20921,
AS-15673,
BC207038,
Q219,
SC-03872,
SY035594,
CAS-3658-77-3,
2,5-dimethyl-4-hydroxy-3-(2H)-furanone,
2.5-dimethyl-4-hydroxy-3-(2H)-furanone,
4-hydroxy-2,5-dimethyl-furan-3(2H)-one,
DB-003486,
TR-014967,
2,5-dimethyl-4-hydroxy-(2h)-furan-3-one,
2,5-dimethyl-4-hydroxy-3-oxo-(2H)-furan,
D1569,
D1884,
FT-0610446,
ST24043773,
ST51036381,
MFCD00010706 (97%),
58H773,
C20717,
2,3-Dihydro-4-hydroxy-2,5-dimethyl-3-furanone,
4-oxo-3-hydroxy-2,5-dimethyl-4,5-dihydrofuran,
2,5-Dimethyl-4-hydroxy-2,3-dihydro-furan-3-one,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone solution,
A823300,
I14-0734,
Q-100434,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone, >=99.0% (GC),
4-Hydroxy-2,5-dimethyl-3(2H)-furanone, >=98%, FCC, FG,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone, analytical standard,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone, natural, >=98%, FG,
InChI=1/C6H8O3/c1-3-5(7)6(8)4(2)9-3/h3,8H,1-2H,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone solution, 10 wt. % in propylene glycol,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone, 15 wt. % (in propylene glycol), FG,
UNII-20PI8YZP7A,
C6H8O3,
20PI8YZP7A,
C6-H8-O3,
CID19309,
4-Hydroxy-2,5-dimethyl-3 furanone,
3(2h)-furanona, 4-hidroxi-2,5-dimetil-,
(R)-4-Hydroxy-2,5-dimethyl-3(2H)-furanone,
(S)-4-Hydroxy-2,5-dimethyl-3(2H)-furanone,
4- hydroxy- 2, 5- dimethylfuran- 2(3H)- one,
3(2H)-Furanone, 4-hydroxy-2,5-dimethyl-, (R)-,
3(2H)-Furanone, 4-hydroxy-2,5-dimethyl-, (S)-,
4 - hydroxy - 2,5 - dimethylfuran - 2(3H) - one,
4-Hydroxy-2,5-dimethyl-3(2H)-furanone, 95% - 25G 25g,
192466-95-8,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.127g/mol |
| Monoisotopic Mass | 128.047g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
| Symbol: | |
| Hazard statements | H302 |
| Precuationary statements | P280-P305+P351+P338 |
| Siginal words | |
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| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
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