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622387-06-8 | 1-Bromo-4-(4,4,4-trifluorobutoxy)benzene
CAS No: 622387-06-8 Catalog No: AG01EWOD MDL No:
Product Description
Catalog Number:
AG01EWOD
Chemical Name:
1-Bromo-4-(4,4,4-trifluorobutoxy)benzene
CAS Number:
622387-06-8
Molecular Formula:
C10H10BrF3O
Molecular Weight:
283.0850
IUPAC Name:
1-bromo-4-(4,4,4-trifluorobutoxy)benzene
InChI:
InChI=1S/C10H10BrF3O/c11-8-2-4-9(5-3-8)15-7-1-6-10(12,13)14/h2-5H,1,6-7H2
InChI Key:
MTOCRHOPLAYFLZ-UHFFFAOYSA-N
SMILES:
FC(CCCOc1ccc(cc1)Br)(F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.987g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.088g/mol
Monoisotopic Mass:
281.987g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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