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2- (3-Chlorophenyl) -5-methylmorpholine hydrochloride

CAT: 0926-DXC56119-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-DXC56119-01Size:50 mg
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CAS Number
1803561-19-4
MDL Number
MFCD27920310
Smiles
CC1COC (CN1) C2=CC (=CC=C2) Cl.Cl
Molecular Formula
C11H15Cl2NO
Molecular Weight
248.15 g/mol
Controlled
No

Chemical Information

2-(3-Chlorophenyl)-5-methylmorpholine hydrochloride
CAS Number1803561-19-4
PubChem CID75481670
IUPAC Name2-(3-chlorophenyl)-5-methylmorpholine;hydrochloride
Molecular FormulaC11H15Cl2NO
Molecular Weight248.15
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity188
SMILES
CC1COC(CN1)C2=CC(=CC=C2)Cl.Cl
InChI
InChI=1S/C11H14ClNO.ClH/c1-8-7-14-11(6-13-8)9-3-2-4-10(12)5-9;/h2-5,8,11,13H,6-7H2,1H3;1H
InChIKey
FROPKCMWOOAENS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(3-Chlorophenyl)-5-methylmorpholine hydrochloride
CAS: 1803561-19-4
CID: 75481670
Formula: C11H15Cl2NO
MW: 248.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight248.15
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass247.0530695
Monoisotopic Mass247.0530695
Topological Polar Surface Area21.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity188
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes