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2-Methyl-oxetan-3-one

CAT: 0572-TRC-M324465-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M324465-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
87385-83-9
Hazard Statement
No Data Available
Smiles
CC1OCC1=O
Molecular Formula
C4 H6 O2
Molecular Weight
86.089
InChI
InChI=1S/C4H6O2/c1-3-4(5)2-6-3/h3H,2H2,1H3
Additionnal Information
IUPAC name: 2-methyloxetan-3-one
Shipping Conditions
Room Temperature

Chemical Information

2-Methyloxetan-3-one
CAS Number87385-83-9
PubChem CID13111185
IUPAC Name2-methyloxetan-3-one
Molecular FormulaC4H6O2
Molecular Weight86.09
XLogP0.1
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity77
SMILES
CC1C(=O)CO1
InChI
InChI=1S/C4H6O2/c1-3-4(5)2-6-3/h3H,2H2,1H3
InChIKey
NOVNNMPBRZQLHL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methyloxetan-3-one
CAS: 87385-83-9
CID: 13111185
Formula: C4H6O2
MW: 86.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight86.09
XLogP30.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass86.036779430
Monoisotopic Mass86.036779430
Topological Polar Surface Area26.3 Ų
Heavy Atom Count6
Formal Charge0
Complexity77.6
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

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Alternative Products

CatalogName
418787-012-Methyl-oxetan-3-one
OR309076-01Methyl 2- (oxetan-3-ylidene) acetate
286252-01Oxetan-3-one
VAD31491-011-Methyl-2- (oxetan-3-yl) piperazine
OR306118N-[ (2-Nitrophenyl) methyl]oxetan-3-amine
OR306116N-[ (2-Methoxyphenyl) methyl]oxetan-3-amine
KHC95431-012-Methyl-4- (oxetan-3-yloxy) aniline
TDC96718-01N-[ (2-Chlorophenyl) methyl]oxetan-3-amine
UQA65339-01Methyl 2- (benzyloxycarbonylamino) -2- (oxetan-3-ylidene) acetate
EWC64835-01Methyl 2- (methylamino) -2- (oxetan-3-yl) acetate

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