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6- (Hydroxymethyl) -2-methylquinoline

CAT: 0127-OR14489-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR14489-01Size:1 g
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CAS Number
108166-02-5
Synonyms
(2-Methylquinolin-6-yl) methanol, 6- (Hydroxymethyl) -2-methyl-1-azanaphthalene
MDL Number
MFCD06659066
Purity
=95%
Smiles
Cc1ccc2cc(CO)ccc2n1

Chemical Information

(2-Methylquinolin-6-yl)methanol
CAS Number108166-02-5
PubChem CID2795481
IUPAC Name(2-methylquinolin-6-yl)methanol
Molecular FormulaC11H11NO
Molecular Weight173.21
XLogP1.7
Topological Polar Surface Area33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity171
SMILES
CC1=NC2=C(C=C1)C=C(C=C2)CO
InChI
InChI=1S/C11H11NO/c1-8-2-4-10-6-9(7-13)3-5-11(10)12-8/h2-6,13H,7H2,1H3
InChIKey
HLFYJILNIBADGG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2-Methylquinolin-6-yl)methanol
CAS: 108166-02-5
CID: 2795481
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 Count1
Exact Mass173.084063974
Monoisotopic Mass173.084063974
Topological Polar Surface Area33.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity171
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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