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2- (Hydroxymethyl) morpholin-3-one

CAT: 0926-NPC26041-02Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-NPC26041-02Size:0.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1613260-41-5
MDL Number
MFCD30749902
Smiles
C1COC (C (=O) N1) CO
Molecular Formula
C5H9NO3
Molecular Weight
131.13 g/mol
Controlled
No

Chemical Information

2-(Hydroxymethyl)morpholin-3-one
CAS Number1613260-41-5
PubChem CID68311152
IUPAC Name2-(hydroxymethyl)morpholin-3-one
Molecular FormulaC5H9NO3
Molecular Weight131.13
XLogP-0.9
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity115
SMILES
C1COC(C(=O)N1)CO
InChI
InChI=1S/C5H9NO3/c7-3-4-5(8)6-1-2-9-4/h4,7H,1-3H2,(H,6,8)
InChIKey
NXEHXLPXNGDPKZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Hydroxymethyl)morpholin-3-one
CAS: 1613260-41-5
CID: 68311152
Formula: C5H9NO3
MW: 131.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.13
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass131.058243149
Monoisotopic Mass131.058243149
Topological Polar Surface Area58.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity115
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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