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914636-26-3

914636-26-3 | 4-Bromo-3-(trifluoromethyl)benzoyl chloride

CAS No: 914636-26-3 Catalog No: AG01EZ1L MDL No:

Product Description

Catalog Number:
AG01EZ1L
Chemical Name:
4-Bromo-3-(trifluoromethyl)benzoyl chloride
CAS Number:
914636-26-3
Molecular Formula:
C8H3BrClF3O
Molecular Weight:
287.4610
IUPAC Name:
4-bromo-3-(trifluoromethyl)benzoyl chloride
InChI:
InChI=1S/C8H3BrClF3O/c9-6-2-1-4(7(10)14)3-5(6)8(11,12)13/h1-3H
InChI Key:
SMHDYUSXHFGSOR-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(c(c1)C(F)(F)F)Br

Properties

Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.901g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.46g/mol
Monoisotopic Mass:
285.901g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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