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Home > Bromides > 1314987-38-6
1314987-38-6 | Benzene, 1-bromo-4-(dimethoxymethyl)-2-(trifluoromethyl)-
CAS No: 1314987-38-6 Catalog No: AG000WBQ MDL No:MFCD19684125
Product Description
Catalog Number:
AG000WBQ
Chemical Name:
Benzene, 1-bromo-4-(dimethoxymethyl)-2-(trifluoromethyl)-
CAS Number:
1314987-38-6
Molecular Formula:
C10H10BrF3O2
Molecular Weight:
299.0844
MDL Number:
MFCD19684125
IUPAC Name:
1-bromo-4-(dimethoxymethyl)-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C10H10BrF3O2/c1-15-9(16-2)6-3-4-8(11)7(5-6)10(12,13)14/h3-5,9H,1-2H3
InChI Key:
VJXCLYNQGFPBNV-UHFFFAOYSA-N
SMILES:
COC(c1ccc(c(c1)C(F)(F)F)Br)OC
Properties
Complexity:
219
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:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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