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Home > Bromides > 1349716-76-2
1349716-76-2 | 2,6-Difluoro-4-bromotoluene (methyl D3)
CAS No: 1349716-76-2 Catalog No: AG01FCBW MDL No:MFCD20233384
Product Description
Catalog Number:
AG01FCBW
Chemical Name:
2,6-Difluoro-4-bromotoluene (methyl D3)
CAS Number:
1349716-76-2
Molecular Formula:
C7H2BrD3F2
Molecular Weight:
210.0339
MDL Number:
MFCD20233384
IUPAC Name:
5-bromo-1,3-difluoro-2-(trideuteriomethyl)benzene
InChI:
InChI=1S/C7H5BrF2/c1-4-6(9)2-5(8)3-7(4)10/h2-3H,1H3/i1D3
InChI Key:
NGINOAWMGMGBPJ-FIBGUPNXSA-N
SMILES:
Brc1cc(F)c(c(c1)F)C([2H])([2H])[2H]
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.973g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
3
Molecular Weight:
210.036g/mol
Monoisotopic Mass:
208.973g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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