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2- (1H-Imidazol-2-yl) morpholine

CAT: 0926-VGC79210-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-VGC79210-01Size:50 mg
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CAS Number
1420792-10-4
MDL Number
MFCD22398592
Smiles
C1COC (CN1) C2=NC=CN2.Cl
Molecular Formula
C7H12ClN3O
Molecular Weight
189.64 g/mol
Controlled
No

Chemical Information

2-(1H-imidazol-2-yl)morpholine
CAS Number1420792-10-4
PubChem CID82595193
IUPAC Name2-(1H-imidazol-2-yl)morpholine
Molecular FormulaC7H11N3O
Molecular Weight153.18
XLogP-0.9
Topological Polar Surface Area49.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity131
SMILES
C1COC(CN1)C2=NC=CN2
InChI
InChI=1S/C7H11N3O/c1-2-10-7(9-1)6-5-8-3-4-11-6/h1-2,6,8H,3-5H2,(H,9,10)
InChIKey
KMGHOGSBGFJQQC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(1H-imidazol-2-yl)morpholine
CAS: 1420792-10-4
CID: 82595193
Formula: C7H11N3O
MW: 153.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight153.18
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass153.090211983
Monoisotopic Mass153.090211983
Topological Polar Surface Area49.9 Ų
Heavy Atom Count11
Formal Charge0
Complexity131
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