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N- (4-Hydroxybutyl) morpholine-4-carboxamide

CAT: 0926-USC44424-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-USC44424-01Size:50 mg
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CAS Number
1694444-24-0
MDL Number
MFCD32066369
Smiles
C1COCCN1C (=O) NCCCCO
Molecular Formula
C9H18N2O3
Molecular Weight
202.3 g/mol
Controlled
No

Chemical Information

N-(4-hydroxybutyl)morpholine-4-carboxamide
CAS Number1694444-24-0
PubChem CID106843868
IUPAC NameN-(4-hydroxybutyl)morpholine-4-carboxamide
Molecular FormulaC9H18N2O3
Molecular Weight202.25
XLogP-0.8
Topological Polar Surface Area61.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity169
SMILES
C1COCCN1C(=O)NCCCCO
InChI
InChI=1S/C9H18N2O3/c12-6-2-1-3-10-9(13)11-4-7-14-8-5-11/h12H,1-8H2,(H,10,13)
InChIKey
HKRNXVGCWAAOMX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-hydroxybutyl)morpholine-4-carboxamide
CAS: 1694444-24-0
CID: 106843868
Formula: C9H18N2O3
MW: 202.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight202.25
XLogP3-0.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass202.13174244
Monoisotopic Mass202.13174244
Topological Polar Surface Area61.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity169
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