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898761-70-1

898761-70-1 | 3-(4-Bromophenyl)-2'-fluoropropiophenone

CAS No: 898761-70-1 Catalog No: AG01EYVC MDL No:

Product Description

Catalog Number:
AG01EYVC
Chemical Name:
3-(4-Bromophenyl)-2'-fluoropropiophenone
CAS Number:
898761-70-1
Molecular Formula:
C15H12BrFO
Molecular Weight:
307.1576
IUPAC Name:
3-(4-bromophenyl)-1-(2-fluorophenyl)propan-1-one
InChI:
InChI=1S/C15H12BrFO/c16-12-8-5-11(6-9-12)7-10-15(18)13-3-1-2-4-14(13)17/h1-6,8-9H,7,10H2
InChI Key:
OCBQKGYIUZIBOX-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)CCC(=O)c1ccccc1F

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.006g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.162g/mol
Monoisotopic Mass:
306.006g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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