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1417794-54-7 | Benzenemethanamine, N-ethyl-3-fluoro-N-[(3-fluorophenyl)methyl]-
CAS No: 1417794-54-7 Catalog No: AG001H5V MDL No:MFCD22631781
Product Description
Catalog Number:
AG001H5V
Chemical Name:
Benzenemethanamine, N-ethyl-3-fluoro-N-[(3-fluorophenyl)methyl]-
CAS Number:
1417794-54-7
Molecular Formula:
C16H17F2N
Molecular Weight:
261.3097
MDL Number:
MFCD22631781
IUPAC Name:
N,N-bis[(3-fluorophenyl)methyl]ethanamine
InChI:
InChI=1S/C16H17F2N/c1-2-19(11-13-5-3-7-15(17)9-13)12-14-6-4-8-16(18)10-14/h3-10H,2,11-12H2,1H3
InChI Key:
RUFUOOQAEJFOCC-UHFFFAOYSA-N
SMILES:
CCN(Cc1cccc(c1)F)Cc1cccc(c1)F
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.133g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.316g/mol
Monoisotopic Mass:
261.133g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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