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210414-95-2 | 4-Bromo-2,6-diethylfluorobenzene
CAS No: 210414-95-2 Catalog No: AG01FERA MDL No:MFCD11845989
Product Description
Catalog Number:
AG01FERA
Chemical Name:
4-Bromo-2,6-diethylfluorobenzene
CAS Number:
210414-95-2
Molecular Formula:
C10H12BrF
Molecular Weight:
231.1047
MDL Number:
MFCD11845989
IUPAC Name:
5-bromo-1,3-diethyl-2-fluorobenzene
InChI:
InChI=1S/C10H12BrF/c1-3-7-5-9(11)6-8(4-2)10(7)12/h5-6H,3-4H2,1-2H3
InChI Key:
MYKVQCPCJOTNHP-UHFFFAOYSA-N
SMILES:
CCc1cc(Br)cc(c1F)CC
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.011g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.108g/mol
Monoisotopic Mass:
230.011g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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