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696-39-9 | 1-Ethyl-3-fluorobenzene
CAS No: 696-39-9 Catalog No: AG005JY2 MDL No:MFCD15527193
Product Description
Catalog Number:
AG005JY2
Chemical Name:
1-Ethyl-3-fluorobenzene
CAS Number:
696-39-9
Molecular Formula:
C8H9F
Molecular Weight:
124.1555
MDL Number:
MFCD15527193
IUPAC Name:
1-ethyl-3-fluorobenzene
InChI:
InChI=1S/C8H9F/c1-2-7-4-3-5-8(9)6-7/h3-6H,2H2,1H3
InChI Key:
ZEWGMOQWTWMZMZ-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1)F
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.069g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.158g/mol
Monoisotopic Mass:
124.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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