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82121-08-2 | 7-Methylquinolin-4-ol
CAS No: 82121-08-2 Catalog No: AG005AA8 MDL No:MFCD00169015
Product Description
Catalog Number:
AG005AA8
Chemical Name:
7-Methylquinolin-4-ol
CAS Number:
82121-08-2
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD00169015
IUPAC Name:
7-methyl-1H-quinolin-4-one
InChI:
InChI=1S/C10H9NO/c1-7-2-3-8-9(6-7)11-5-4-10(8)12/h2-6H,1H3,(H,11,12)
InChI Key:
JPVTWKDGBWUNBQ-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nccc2O
EC Number:
300-039-6
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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