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88474-21-9 | Quinoline, 8-(bromomethyl)-5-fluoro-
CAS No: 88474-21-9 Catalog No: AG0049Q0 MDL No:MFCD09047613
Product Description
Catalog Number:
AG0049Q0
Chemical Name:
Quinoline, 8-(bromomethyl)-5-fluoro-
CAS Number:
88474-21-9
Molecular Formula:
C10H7BrFN
Molecular Weight:
240.0717
MDL Number:
MFCD09047613
IUPAC Name:
8-(bromomethyl)-5-fluoroquinoline
InChI:
InChI=1S/C10H7BrFN/c11-6-7-3-4-9(12)8-2-1-5-13-10(7)8/h1-5H,6H2
InChI Key:
PJKGHXPXMQHCQM-UHFFFAOYSA-N
SMILES:
BrCc1ccc(c2c1nccc2)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.975g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.075g/mol
Monoisotopic Mass:
238.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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