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Home > Fluorides > 1242339-58-7
1242339-58-7 | 3-Fluoro-5-methoxy-N,N-dimethylaniline
CAS No: 1242339-58-7 Catalog No: AG01FCKU MDL No:MFCD15530345
Product Description
Catalog Number:
AG01FCKU
Chemical Name:
3-Fluoro-5-methoxy-N,N-dimethylaniline
CAS Number:
1242339-58-7
Molecular Formula:
C9H12FNO
Molecular Weight:
169.1961
MDL Number:
MFCD15530345
IUPAC Name:
3-fluoro-5-methoxy-N,N-dimethylaniline
InChI:
InChI=1S/C9H12FNO/c1-11(2)8-4-7(10)5-9(6-8)12-3/h4-6H,1-3H3
InChI Key:
ZMTVPYLLGOBCHA-UHFFFAOYSA-N
SMILES:
COc1cc(F)cc(c1)N(C)C
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.199g/mol
Monoisotopic Mass:
169.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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