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848128-87-0 | 6-Isopropylquinolin-4-ol
CAS No: 848128-87-0 Catalog No: AG008GB7 MDL No:MFCD09743942
Product Description
Catalog Number:
AG008GB7
Chemical Name:
6-Isopropylquinolin-4-ol
CAS Number:
848128-87-0
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD09743942
IUPAC Name:
6-propan-2-yl-1H-quinolin-4-one
InChI:
InChI=1S/C12H13NO/c1-8(2)9-3-4-11-10(7-9)12(14)5-6-13-11/h3-8H,1-2H3,(H,13,14)
InChI Key:
COBMIRHGFBVZHB-UHFFFAOYSA-N
SMILES:
CC(c1ccc2c(c1)c(O)ccn2)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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