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200956-32-7 | Benzene, 2-bromo-1-(phenylmethoxy)-4-(trifluoromethyl)-
CAS No: 200956-32-7 Catalog No: AG002D3D MDL No:MFCD11856016
Product Description
Catalog Number:
AG002D3D
Chemical Name:
Benzene, 2-bromo-1-(phenylmethoxy)-4-(trifluoromethyl)-
CAS Number:
200956-32-7
Molecular Formula:
C14H10BrF3O
Molecular Weight:
331.1278
MDL Number:
MFCD11856016
IUPAC Name:
2-bromo-1-phenylmethoxy-4-(trifluoromethyl)benzene
InChI:
InChI=1S/C14H10BrF3O/c15-12-8-11(14(16,17)18)6-7-13(12)19-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:
VIGCXRMJHAZXGW-UHFFFAOYSA-N
SMILES:
Brc1cc(ccc1OCc1ccccc1)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:
4.9
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