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53936-95-1 | (2-METHYLQUINOLIN-3-YL)METHANOL
CAS No: 53936-95-1 Catalog No: AG01EMIN MDL No:MFCD15833016
Product Description
Catalog Number:
AG01EMIN
Chemical Name:
(2-METHYLQUINOLIN-3-YL)METHANOL
CAS Number:
53936-95-1
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD15833016
IUPAC Name:
(2-methylquinolin-3-yl)methanol
InChI:
InChI=1S/C11H11NO/c1-8-10(7-13)6-9-4-2-3-5-11(9)12-8/h2-6,13H,7H2,1H3
InChI Key:
NJEKQDADEISXFB-UHFFFAOYSA-N
SMILES:
OCc1cc2ccccc2nc1C
NSC Number:
165994
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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