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1369841-47-3 | Benzenamine, 3-(1,1-dimethylethoxy)-5-(trifluoromethyl)-
CAS No: 1369841-47-3 Catalog No: AG0012MU MDL No:MFCD24344345
Product Description
Catalog Number:
AG0012MU
Chemical Name:
Benzenamine, 3-(1,1-dimethylethoxy)-5-(trifluoromethyl)-
CAS Number:
1369841-47-3
Molecular Formula:
C11H14F3NO
Molecular Weight:
233.2302
MDL Number:
MFCD24344345
IUPAC Name:
3-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)aniline
InChI:
InChI=1S/C11H14F3NO/c1-10(2,3)16-9-5-7(11(12,13)14)4-8(15)6-9/h4-6H,15H2,1-3H3
InChI Key:
YMSZEEUQAUPZMI-UHFFFAOYSA-N
SMILES:
Nc1cc(cc(c1)C(F)(F)F)OC(C)(C)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.103g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.234g/mol
Monoisotopic Mass:
233.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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