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2-Hexanone, 5-hydroxy

CAT: 0024-sc-361830Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-361830Size:1 g
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CAS Number
56745-61-0

Chemical Information

5-Hydroxy-2-hexanone

5-hydroxyhexan-2-one is a ketone that is hexan-2-one in which one of the hydrogens at position 5 is replaced by a hydroxy group. It is a ketone and a secondary alcohol.

CAS Number56745-61-0
PubChem CID114801
IUPAC Name5-hydroxyhexan-2-one
Molecular FormulaC6H12O2
Molecular Weight116.16
XLogP0
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count8
Formal Charge0
Complexity78
SMILES
CC(CCC(=O)C)O
InChI
InChI=1S/C6H12O2/c1-5(7)3-4-6(2)8/h5,7H,3-4H2,1-2H3
InChIKey
ZSDLLTJVENEIDW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Hydroxy-2-hexanone
CAS: 56745-61-0
CID: 114801
Formula: C6H12O2
MW: 116.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight116.16
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass116.083729621
Monoisotopic Mass116.083729621
Topological Polar Surface Area37.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity78.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
sc-4835453-Hydroxy-2-hexanone
sc-2390555-Methyl-2-hexanone
sc-239055A5-Methyl-2-hexanone
sc-238063A2-Hexanone
sc-4861135-Methyl-2-hexanone Oxime
sc-4878272,5-Dimethyl-3-hexanone
sc-2380632-Hexanone
sc-4828345-Methyl-3-methylene-2-hexanone
sc-4830543- (Dimethylaminomethyl) -5-methyl-2-hexanone
sc-4877293-Methyl-2-hexanone

Alternative Products

CatalogName
TRC-M311905-50ML5-Methyl-2-hexanone
M196805-Methyl-2-Hexanone Oxime
OR1010109-012,5-Dimethyl-3-Hexanone
FD161472-013- (Dimethylaminomethyl) -5-methyl-2-hexanone
TRC-M322950-1G5-Methyl-3-methylene-2-hexanone
OR1009412-011-Bromo-5-Hexanone
M19650-013-Methyl-5-hexanone 90%
abx1883083-(N,N-Dimethylaminomethyl)-5-Methyl-2-Hexanone
TRC-B114995-100MG1-(1,3-Benzodioxol-5-yl)-2-bromo-1-hexanone
GTR19270590-012-hydroxy-5-{3-hydroxy-2-[2-hydroxy-5- (hydroxypropyl) -methoxyphenyl]propanoyl}-methoxybenzoic acid

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