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(2R,6R) -2,6-Dimethylmorpholine

CAT: 0926-FD74924-01Size: 2 gDry Ice: NoHazardous: No
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CAT#:0926-FD74924-01Size:2 g
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CAS Number
171753-74-5
Synonyms
(2R-trans) -2,6-Dimethylmorpholine
MDL Number
MFCD18250270
Smiles
C[C@@H]1CNC[C@H] (O1) C
Molecular Formula
C6H13NO
Molecular Weight
115.17 g/mol
Controlled
No

Chemical Information

2,6-Dimethylmorpholine, (2R,6R)-
CAS Number171753-74-5
PubChem CID11137133
IUPAC Name(2R,6R)-2,6-dimethylmorpholine
Molecular FormulaC6H13NO
Molecular Weight115.17
XLogP0.3
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity66
SMILES
C[C@@H]1CNC[C@H](O1)C
InChI
InChI=1S/C6H13NO/c1-5-3-7-4-6(2)8-5/h5-7H,3-4H2,1-2H3/t5-,6-/m1/s1
InChIKey
HNVIQLPOGUDBSU-PHDIDXHHSA-N
Chemical Structure
2D Structure
2D structure of 2,6-Dimethylmorpholine, (2R,6R)-
CAS: 171753-74-5
CID: 11137133
Formula: C6H13NO
MW: 115.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight115.17
XLogP30.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass115.099714038
Monoisotopic Mass115.099714038
Topological Polar Surface Area21.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.9
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes