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2357-52-0 | Benzene, 4-bromo-2-fluoro-1-methoxy-
CAS No: 2357-52-0 Catalog No: AG002NPV MDL No:MFCD00011710
Product Description
Catalog Number:
AG002NPV
Chemical Name:
Benzene, 4-bromo-2-fluoro-1-methoxy-
CAS Number:
2357-52-0
Molecular Formula:
C7H6BrFO
Molecular Weight:
205.0243
MDL Number:
MFCD00011710
IUPAC Name:
4-bromo-2-fluoro-1-methoxybenzene
InChI:
InChI=1S/C7H6BrFO/c1-10-7-3-2-5(8)4-6(7)9/h2-4H,1H3
InChI Key:
DWNXGZBXFDNKOR-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)Br
EC Number:
219-096-2
NSC Number:
10329
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.959g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.026g/mol
Monoisotopic Mass:
203.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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