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294175-07-8 | Phenol, 4-(1-amino-2,2,2-trifluoroethyl)-
CAS No: 294175-07-8 Catalog No: AG002YA5 MDL No:MFCD09832191
Product Description
Catalog Number:
AG002YA5
Chemical Name:
Phenol, 4-(1-amino-2,2,2-trifluoroethyl)-
CAS Number:
294175-07-8
Molecular Formula:
C8H8F3NO
Molecular Weight:
191.1504
MDL Number:
MFCD09832191
IUPAC Name:
4-(1-amino-2,2,2-trifluoroethyl)phenol
InChI:
InChI=1S/C8H8F3NO/c9-8(10,11)7(12)5-1-3-6(13)4-2-5/h1-4,7,13H,12H2
InChI Key:
XIBJQYMKBQZQPP-UHFFFAOYSA-N
SMILES:
NC(C(F)(F)F)c1ccc(cc1)O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.153g/mol
Monoisotopic Mass:
191.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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