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104197-14-0 | 5-Bromo-1,3-difluoro-2-methoxybenzene
CAS No: 104197-14-0 Catalog No: AG003KVV MDL No:MFCD01631351
Product Description
Catalog Number:
AG003KVV
Chemical Name:
5-Bromo-1,3-difluoro-2-methoxybenzene
CAS Number:
104197-14-0
Molecular Formula:
C7H5BrF2O
Molecular Weight:
223.0148
MDL Number:
MFCD01631351
IUPAC Name:
5-bromo-1,3-difluoro-2-methoxybenzene
InChI:
InChI=1S/C7H5BrF2O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3
InChI Key:
CDOQKISJPOWBKC-UHFFFAOYSA-N
SMILES:
COc1c(F)cc(cc1F)Br
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.017g/mol
Monoisotopic Mass:
221.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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