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176912-29-1 | 2(1H)-Quinolinone, 4-(bromomethyl)-8-fluoro-
CAS No: 176912-29-1 Catalog No: AG0024ZG MDL No:MFCD18711491
Product Description
Catalog Number:
AG0024ZG
Chemical Name:
2(1H)-Quinolinone, 4-(bromomethyl)-8-fluoro-
CAS Number:
176912-29-1
Molecular Formula:
C10H7BrFNO
Molecular Weight:
256.0711
MDL Number:
MFCD18711491
IUPAC Name:
4-(bromomethyl)-8-fluoro-1H-quinolin-2-one
InChI:
InChI=1S/C10H7BrFNO/c11-5-6-4-9(14)13-10-7(6)2-1-3-8(10)12/h1-4H,5H2,(H,13,14)
InChI Key:
ZYDYBCDPBZBCEM-UHFFFAOYSA-N
SMILES:
BrCc1cc(=O)[nH]c2c1cccc2F
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.97g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.074g/mol
Monoisotopic Mass:
254.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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