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4-Methylmorpholine N-oxide

CAT: 0804-HY-Y1101B-06Size: 1 KgDry Ice: NoHazardous: No
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CAT#:0804-HY-Y1101B-06Size:1 Kg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
4-Methylmorpholine N-oxide (N-Methylmorpholine N-Oxide) is an organic compound used as a cellulose solvent in the production of cellulose fibers[1].
CAS Number
7529-22-8
Product Name Alternative
N-Methylmorpholine N-Oxide; MMNO; 4-Methylmorpholine 4-oxide
UNSPSC
12352005
Hazard Statement
H228, H361
Target
Others
Related Pathways
Others
Field of Research
Others
Purity
98.60
Smiles
C[N+]1([O-])CCOCC1
Molecular Formula
C5H11NO2
Molecular Weight
117.15
Precautions
H228, H361
References & Citations
[1]Clewell RA, et al. An in vitro approach to determine the human relevance of anti-spermatogenic effects of 4-methylmorpholine 4-oxide, monohydrate (NMMO) in rat reproductive toxicity studies. Toxicol In Vitro. 2022 Aug;82:105365.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture)
Scientific Category
Reference compound2
Clinical Information
No Development Reported

Chemical Information

Methyl morpholine oxide

N-methylmorpholine N-oxide is a morpholine N-oxide resulting from the oxidation of the amino group of N-methylmorpholine.

CAS Number7529-22-8
PubChem CID82029
IUPAC Name4-methyl-4-oxidomorpholin-4-ium
Molecular FormulaC5H11NO2
Molecular Weight117.15
XLogP-0.7
Topological Polar Surface Area27.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity78
SMILES
C[N+]1(CCOCC1)[O-]
InChI
InChI=1S/C5H11NO2/c1-6(7)2-4-8-5-3-6/h2-5H2,1H3
InChIKey
LFTLOKWAGJYHHR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl morpholine oxide
CAS: 7529-22-8
CID: 82029
Formula: C5H11NO2
MW: 117.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight117.15
XLogP3-0.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass117.078978594
Monoisotopic Mass117.078978594
Topological Polar Surface Area27.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity78.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes