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2-[ (2-Methoxyethoxy) methyl]morpholine

CAT: 0926-PDC12965-02Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-PDC12965-02Size:0.5 g
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CAS Number
1339129-65-5
MDL Number
MFCD20317236
Smiles
COCCOCC1CNCCO1
Molecular Formula
C8H17NO3
Molecular Weight
175.2 g/mol
Controlled
No

Chemical Information

2-[(2-Methoxyethoxy)methyl]morpholine
CAS Number1339129-65-5
PubChem CID64533055
IUPAC Name2-(2-methoxyethoxymethyl)morpholine
Molecular FormulaC8H17NO3
Molecular Weight175.23
XLogP-0.8
Topological Polar Surface Area39.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity110
SMILES
COCCOCC1CNCCO1
InChI
InChI=1S/C8H17NO3/c1-10-4-5-11-7-8-6-9-2-3-12-8/h8-9H,2-7H2,1H3
InChIKey
QYWXSKQVJSCVGG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[(2-Methoxyethoxy)methyl]morpholine
CAS: 1339129-65-5
CID: 64533055
Formula: C8H17NO3
MW: 175.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight175.23
XLogP3-0.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass175.12084340
Monoisotopic Mass175.12084340
Topological Polar Surface Area39.7 Ų
Heavy Atom Count12
Formal Charge0
Complexity110
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