Home Aminos 3-amino-1-(4-fluorophenyl)butan-1-one hydrochloride

3-amino-1-(4-fluorophenyl)butan-1-one hydrochloride

CAS No.:
1394041-57-6
Catalog Number:
AG01A064
Molecular Formula:
C10H13ClFNO
Molecular Weight:
217.6677
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Product Description
Catalog Number:
AG01A064
Chemical Name:
3-amino-1-(4-fluorophenyl)butan-1-one hydrochloride
CAS Number:
1394041-57-6
Molecular Formula:
C10H13ClFNO
Molecular Weight:
217.6677
MDL Number:
MFCD22378641
IUPAC Name:
3-amino-1-(4-fluorophenyl)butan-1-one;hydrochloride
InChI:
InChI=1S/C10H12FNO.ClH/c1-7(12)6-10(13)8-2-4-9(11)5-3-8;/h2-5,7H,6,12H2,1H3;1H
InChI Key:
NPWVKNZAGLVNHW-UHFFFAOYSA-N
SMILES:
CC(CC(=O)c1ccc(cc1)F)N.Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.668g/mol
Monoisotopic Mass:
217.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties