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2-Propylmorpholine

CAT: 0926-PDA85503-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-PDA85503-01Size:50 mg
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CAS Number
89855-03-8
MDL Number
MFCD14582708
Smiles
CCCC1CNCCO1
Molecular Formula
C7H15NO
Molecular Weight
129.2 g/mol
Controlled
No

Chemical Information

2-Propylmorpholine
CAS Number89855-03-8
PubChem CID20205646
IUPAC Name2-propylmorpholine
Molecular FormulaC7H15NO
Molecular Weight129.20
XLogP0.7
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity75
SMILES
CCCC1CNCCO1
InChI
InChI=1S/C7H15NO/c1-2-3-7-6-8-4-5-9-7/h7-8H,2-6H2,1H3
InChIKey
QGJFIIKVYPIQAZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Propylmorpholine
CAS: 89855-03-8
CID: 20205646
Formula: C7H15NO
MW: 129.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight129.20
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass129.115364102
Monoisotopic Mass129.115364102
Topological Polar Surface Area21.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity75.3
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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