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286017-70-7

286017-70-7 | 2,2,2-trifluoro-1-(3-isopropoxyphenyl)ethanone

CAS No: 286017-70-7 Catalog No: AG01EUOH MDL No:MFCD06201805

Product Description

Catalog Number:
AG01EUOH
Chemical Name:
2,2,2-trifluoro-1-(3-isopropoxyphenyl)ethanone
CAS Number:
286017-70-7
Molecular Formula:
C11H11F3O2
Molecular Weight:
232.1990
MDL Number:
MFCD06201805
IUPAC Name:
2,2,2-trifluoro-1-(3-propan-2-yloxyphenyl)ethanone
InChI:
InChI=1S/C11H11F3O2/c1-7(2)16-9-5-3-4-8(6-9)10(15)11(12,13)14/h3-7H,1-2H3
InChI Key:
GRGNWXUHGZOLKF-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1)C(=O)C(F)(F)F)C

Properties

Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.071g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.202g/mol
Monoisotopic Mass:
232.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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