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2-PHENYLMORPHOLINE

CAT: 0013-GTR19257439-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19257439-03Size:100 mg
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Description
2-PHENYLMORPHOLINE, with CAS No. 23972-41-0, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 2-PHENYLMORPHOLINE provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
23972-41-0
Purity
≥95% (May vary between batches)
Smiles
C1COC (CN1) c1ccccc1
Molecular Formula
C10H13NO
Molecular Weight
163.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Phenylmorpholine
CAS Number23972-41-0
PubChem CID91101
IUPAC Name2-phenylmorpholine
Molecular FormulaC10H13NO
Molecular Weight163.22
XLogP1.1
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity132
SMILES
C1COC(CN1)C2=CC=CC=C2
InChI
InChI=1S/C10H13NO/c1-2-4-9(5-3-1)10-8-11-6-7-12-10/h1-5,10-11H,6-8H2
InChIKey
ZLNGFYDJXZZFJP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Phenylmorpholine
CAS: 23972-41-0
CID: 91101
Formula: C10H13NO
MW: 163.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight163.22
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass163.099714038
Monoisotopic Mass163.099714038
Topological Polar Surface Area21.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity132
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

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