Home Aminos 1-(4-amino-2,3,5-trifluorophenyl)ethan-1-one

1-(4-amino-2,3,5-trifluorophenyl)ethan-1-one

CAS No.:
1260764-37-1
Catalog Number:
AG01A3YT
Molecular Formula:
C8H6F3NO
Molecular Weight:
189.1345
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Product Description
Catalog Number:
AG01A3YT
Chemical Name:
1-(4-amino-2,3,5-trifluorophenyl)ethan-1-one
CAS Number:
1260764-37-1
Molecular Formula:
C8H6F3NO
Molecular Weight:
189.1345
MDL Number:
MFCD11848261
IUPAC Name:
1-(4-amino-2,3,5-trifluorophenyl)ethanone
InChI:
InChI=1S/C8H6F3NO/c1-3(13)4-2-5(9)8(12)7(11)6(4)10/h2H,12H2,1H3
InChI Key:
FKRBAVMUAANWMH-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(F)c(c(c1F)F)N
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.137g/mol
Monoisotopic Mass:
189.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties