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2003-11-4 | 4-(Trifluoromethylthio)phenacyl bromide
CAS No: 2003-11-4 Catalog No: AG01FHGY MDL No:
Product Description
Catalog Number:
AG01FHGY
Chemical Name:
4-(Trifluoromethylthio)phenacyl bromide
CAS Number:
2003-11-4
IUPAC Name:
2-bromo-1-[4-(trifluoromethylsulfanyl)phenyl]ethanone
InChI:
InChI=1S/C9H6BrF3OS/c10-5-8(14)6-1-3-7(4-2-6)15-9(11,12)13/h1-4H,5H2
InChI Key:
AOPCAKLHOFQCSY-UHFFFAOYSA-N
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.927g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.105g/mol
Monoisotopic Mass:
297.927g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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