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Home > Bromides > 1137869-91-0
1137869-91-0 | Benzene, 5-bromo-1-fluoro-3-methoxy-2-nitro-
CAS No: 1137869-91-0 Catalog No: AG0009NS MDL No:MFCD20527806
Product Description
Catalog Number:
AG0009NS
Chemical Name:
Benzene, 5-bromo-1-fluoro-3-methoxy-2-nitro-
CAS Number:
1137869-91-0
Molecular Formula:
C7H5BrFNO3
Molecular Weight:
250.0219
MDL Number:
MFCD20527806
IUPAC Name:
5-bromo-1-fluoro-3-methoxy-2-nitrobenzene
InChI:
InChI=1S/C7H5BrFNO3/c1-13-6-3-4(8)2-5(9)7(6)10(11)12/h2-3H,1H3
InChI Key:
BLGZBPZOEMCFOM-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cc(c1[N+](=O)[O-])F
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.944g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.023g/mol
Monoisotopic Mass:
248.944g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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