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89807-71-6 | Benzenamine, 3-[3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]propyl]-
CAS No: 89807-71-6 Catalog No: AG003Y6L MDL No:
Product Description
Catalog Number:
AG003Y6L
Chemical Name:
Benzenamine, 3-[3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]propyl]-
CAS Number:
89807-71-6
Molecular Formula:
C17H17F4NO
Molecular Weight:
327.3166
IUPAC Name:
3-[3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]propyl]aniline
InChI:
InChI=1S/C17H17F4NO/c18-16(19)17(20,21)23-15-9-3-7-13(11-15)5-1-4-12-6-2-8-14(22)10-12/h2-3,6-11,16H,1,4-5,22H2
InChI Key:
UOVFVWRDHVVLPV-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)CCCc1cccc(c1)OC(C(F)F)(F)F
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.125g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.323g/mol
Monoisotopic Mass:
327.125g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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