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1221793-65-2

1221793-65-2 | Benzene, 1-bromo-3-propoxy-5-(trifluoromethoxy)-

CAS No: 1221793-65-2 Catalog No: AG0016VY MDL No:MFCD16036129

Product Description

Catalog Number:
AG0016VY
Chemical Name:
Benzene, 1-bromo-3-propoxy-5-(trifluoromethoxy)-
CAS Number:
1221793-65-2
Molecular Formula:
C10H10BrF3O2
Molecular Weight:
299.0844
MDL Number:
MFCD16036129
IUPAC Name:
1-bromo-3-propoxy-5-(trifluoromethoxy)benzene
InChI:
InChI=1S/C10H10BrF3O2/c1-2-3-15-8-4-7(11)5-9(6-8)16-10(12,13)14/h4-6H,2-3H2,1H3
InChI Key:
LZBDUUKICVQBKZ-UHFFFAOYSA-N
SMILES:
CCCOc1cc(cc(c1)Br)OC(F)(F)F

Properties

Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.982g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.087g/mol
Monoisotopic Mass:
297.982g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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