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2- (Propylamino) ethanol

CAT: 0127-OR938537-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR938537-01Size:250 mg
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CAS Number
16369-21-4
MDL Number
MFCD00002844
Purity
98%
Smiles
CCCNCCO

Chemical Information

2-(Propylamino)ethanol
CAS Number16369-21-4
PubChem CID85382
IUPAC Name2-(propylamino)ethanol
Molecular FormulaC5H13NO
Molecular Weight103.16
XLogP0
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count7
Formal Charge0
Complexity31
SMILES
CCCNCCO
InChI
InChI=1S/C5H13NO/c1-2-3-6-4-5-7/h6-7H,2-5H2,1H3
InChIKey
BCLSJHWBDUYDTR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Propylamino)ethanol
CAS: 16369-21-4
CID: 85382
Formula: C5H13NO
MW: 103.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight103.16
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass103.099714038
Monoisotopic Mass103.099714038
Topological Polar Surface Area32.3 Ų
Heavy Atom Count7
Formal Charge0
Complexity31.3
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

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