Home Aminos 1-(5-amino-2-fluorophenyl)butan-1-one

1-(5-amino-2-fluorophenyl)butan-1-one

CAS No.:
1864961-13-6
Catalog Number:
AG01DZ63
Molecular Formula:
C10H12FNO
Molecular Weight:
181.2068
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Product Description
Catalog Number:
AG01DZ63
Chemical Name:
1-(5-amino-2-fluorophenyl)butan-1-one
CAS Number:
1864961-13-6
Molecular Formula:
C10H12FNO
Molecular Weight:
181.2068
MDL Number:
MFCD31665118
IUPAC Name:
1-(5-amino-2-fluorophenyl)butan-1-one
InChI:
InChI=1S/C10H12FNO/c1-2-3-10(13)8-6-7(12)4-5-9(8)11/h4-6H,2-3,12H2,1H3
InChI Key:
ICMNCQYCSLRZSP-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1cc(N)ccc1F
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.21g/mol
Monoisotopic Mass:
181.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties