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831-75-4 | 3-(1,1,2,2-Tetrafluoroethoxy)aniline
CAS No: 831-75-4 Catalog No: AG0033G5 MDL No:MFCD00042457
Product Description
Catalog Number:
AG0033G5
Chemical Name:
3-(1,1,2,2-Tetrafluoroethoxy)aniline
CAS Number:
831-75-4
Molecular Formula:
C8H7F4NO
Molecular Weight:
209.1409
MDL Number:
MFCD00042457
IUPAC Name:
3-(1,1,2,2-tetrafluoroethoxy)aniline
InChI:
InChI=1S/C8H7F4NO/c9-7(10)8(11,12)14-6-3-1-2-5(13)4-6/h1-4,7H,13H2
InChI Key:
MWDPEBMCVXNSPL-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)OC(C(F)F)(F)F
EC Number:
212-610-6
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.144g/mol
Monoisotopic Mass:
209.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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