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(S) -3- (4-Methoxyphenyl) morpholine

CAT: 0127-OR1056434Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1056434Size:100 mg
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CAS Number
1212903-56-4
MDL Number
MFCD11016358
Purity
97%
Smiles
COC1=CC=C([C@@H]2NCCOC2)C=C1

Chemical Information

(S)-3-(4-Methoxyphenyl)morpholine
CAS Number1212903-56-4
PubChem CID42183285
IUPAC Name(3S)-3-(4-methoxyphenyl)morpholine
Molecular FormulaC11H15NO2
Molecular Weight193.24
XLogP0.9
Topological Polar Surface Area30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity167
SMILES
COC1=CC=C(C=C1)[C@H]2COCCN2
InChI
InChI=1S/C11H15NO2/c1-13-10-4-2-9(3-5-10)11-8-14-7-6-12-11/h2-5,11-12H,6-8H2,1H3/t11-/m1/s1
InChIKey
BMCOYPKKBOYPHE-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of (S)-3-(4-Methoxyphenyl)morpholine
CAS: 1212903-56-4
CID: 42183285
Formula: C11H15NO2
MW: 193.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight193.24
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass193.110278721
Monoisotopic Mass193.110278721
Topological Polar Surface Area30.5 Ų
Heavy Atom Count14
Formal Charge0
Complexity167
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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