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2- (Quinolin-7-yl) ethanol

CAT: 0926-KAC76236-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-KAC76236-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1260762-36-4
MDL Number
MFCD11109981
Smiles
C1=CC2=C (C=C (C=C2) CCO) N=C1
Molecular Formula
C11H11NO
Molecular Weight
173.21 g/mol
Controlled
No

Chemical Information

2-(Quinolin-7-YL)ethanol
CAS Number1260762-36-4
PubChem CID53403781
IUPAC Name2-quinolin-7-ylethanol
Molecular FormulaC11H11NO
Molecular Weight173.21
XLogP1.7
Topological Polar Surface Area33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity160
SMILES
C1=CC2=C(C=C(C=C2)CCO)N=C1
InChI
InChI=1S/C11H11NO/c13-7-5-9-3-4-10-2-1-6-12-11(10)8-9/h1-4,6,8,13H,5,7H2
InChIKey
QSQLGWHAPKFCOG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Quinolin-7-YL)ethanol
CAS: 1260762-36-4
CID: 53403781
Formula: C11H11NO
MW: 173.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight173.21
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass173.084063974
Monoisotopic Mass173.084063974
Topological Polar Surface Area33.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity160
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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