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Home > Bromides > 1314987-55-7
1314987-55-7 | Benzene, 4-bromo-2-(phenylmethoxy)-1-(trifluoromethyl)-
CAS No: 1314987-55-7 Catalog No: AG000WCY MDL No:MFCD19684126
Product Description
Catalog Number:
AG000WCY
Chemical Name:
Benzene, 4-bromo-2-(phenylmethoxy)-1-(trifluoromethyl)-
CAS Number:
1314987-55-7
Molecular Formula:
C14H10BrF3O
Molecular Weight:
331.1278
MDL Number:
MFCD19684126
IUPAC Name:
4-bromo-2-phenylmethoxy-1-(trifluoromethyl)benzene
InChI:
InChI=1S/C14H10BrF3O/c15-11-6-7-12(14(16,17)18)13(8-11)19-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:
CXZBDQXKMPHRCW-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)OCc1ccccc1)C(F)(F)F
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.987g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.132g/mol
Monoisotopic Mass:
329.987g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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