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834884-26-3 | Quinoline, 2-bromo-4-(1,3-dioxolan-2-yl)-3-fluoro-
CAS No: 834884-26-3 Catalog No: AG004VRC MDL No:
Product Description
Catalog Number:
AG004VRC
Chemical Name:
Quinoline, 2-bromo-4-(1,3-dioxolan-2-yl)-3-fluoro-
CAS Number:
834884-26-3
Molecular Formula:
C12H9BrFNO2
Molecular Weight:
298.1078
IUPAC Name:
2-bromo-4-(1,3-dioxolan-2-yl)-3-fluoroquinoline
InChI:
InChI=1S/C12H9BrFNO2/c13-11-10(14)9(12-16-5-6-17-12)7-3-1-2-4-8(7)15-11/h1-4,12H,5-6H2
InChI Key:
FZJMOMVPPRWQIM-UHFFFAOYSA-N
SMILES:
Brc1nc2ccccc2c(c1F)C1OCCO1
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.98g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.111g/mol
Monoisotopic Mass:
296.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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