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Home > Fluorides > 1314012-52-6
1314012-52-6 | 3-Quinolinol, 7,8-difluoro-
CAS No: 1314012-52-6 Catalog No: AG000W46 MDL No:MFCD28404718
Product Description
Catalog Number:
AG000W46
Chemical Name:
3-Quinolinol, 7,8-difluoro-
CAS Number:
1314012-52-6
Molecular Formula:
C9H5F2NO
Molecular Weight:
181.1389
MDL Number:
MFCD28404718
IUPAC Name:
7,8-difluoroquinolin-3-ol
InChI:
InChI=1S/C9H5F2NO/c10-7-2-1-5-3-6(13)4-12-9(5)8(7)11/h1-4,13H
InChI Key:
SRRUKTJMDNQDGX-UHFFFAOYSA-N
SMILES:
Oc1cnc2c(c1)ccc(c2F)F
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.034g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.142g/mol
Monoisotopic Mass:
181.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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