Products for Research Use Only

1-Pentanol, 5- (p-aminophenoxy) -

CAT: 0013-GTR19224211-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19224211-01Size:100 mg
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Description
This small molecule, 5- (p-Aminophenoxy) -1-pentanol, is a bioactive compound for research use. It serves as a chemical intermediate or building block in medicinal chemistry, with applications in synthesizing compounds for in vitro pharmacological studies.
CAS Number
100055-08-1
Smiles
OCCCCCOC1=CC=C (N) C=C1
Molecular Formula
C11H17NO2
Molecular Weight
195.26
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-Pentanol, 5-(p-aminophenoxy)-
CAS Number100055-08-1
PubChem CID3063177
IUPAC Name5-(4-aminophenoxy)pentan-1-ol
Molecular FormulaC11H17NO2
Molecular Weight195.26
XLogP1.7
Topological Polar Surface Area55.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count14
Formal Charge0
Complexity133
SMILES
C1=CC(=CC=C1N)OCCCCCO
InChI
InChI=1S/C11H17NO2/c12-10-4-6-11(7-5-10)14-9-3-1-2-8-13/h4-7,13H,1-3,8-9,12H2
InChIKey
UGIFBNVGQGRKEM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Pentanol, 5-(p-aminophenoxy)-
CAS: 100055-08-1
CID: 3063177
Formula: C11H17NO2
MW: 195.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight195.26
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass195.125928785
Monoisotopic Mass195.125928785
Topological Polar Surface Area55.5 Ų
Heavy Atom Count14
Formal Charge0
Complexity133
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