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2- (2-Morpholin-4-ylethoxy) aniline

CAT: 0024-sc-259150Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-259150Size:1 g
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CAS Number
64039-56-1

Chemical Information

2-(2-Morpholin-4-ylethoxy)aniline
CAS Number64039-56-1
PubChem CID6484712
IUPAC Name2-(2-morpholin-4-ylethoxy)aniline
Molecular FormulaC12H18N2O2
Molecular Weight222.28
XLogP0.9
Topological Polar Surface Area47.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity195
SMILES
C1COCCN1CCOC2=CC=CC=C2N
InChI
InChI=1S/C12H18N2O2/c13-11-3-1-2-4-12(11)16-10-7-14-5-8-15-9-6-14/h1-4H,5-10,13H2
InChIKey
NJDILKXBXBBAKF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-Morpholin-4-ylethoxy)aniline
CAS: 64039-56-1
CID: 6484712
Formula: C12H18N2O2
MW: 222.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight222.28
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass222.136827821
Monoisotopic Mass222.136827821
Topological Polar Surface Area47.7 Ų
Heavy Atom Count16
Formal Charge0
Complexity195
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

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