Home Other Building Blocks [(2,6-difluorophenyl)methyl](ethyl)amine

[(2,6-difluorophenyl)methyl](ethyl)amine

CAS No.:
1017047-88-9
Catalog Number:
AG01A938
Molecular Formula:
C9H11F2N
Molecular Weight:
171.1871
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Product Description
Catalog Number:
AG01A938
Chemical Name:
[(2,6-difluorophenyl)methyl](ethyl)amine
CAS Number:
1017047-88-9
Molecular Formula:
C9H11F2N
Molecular Weight:
171.1871
MDL Number:
MFCD09941616
IUPAC Name:
N-[(2,6-difluorophenyl)methyl]ethanamine
InChI:
InChI=1S/C9H11F2N/c1-2-12-6-7-8(10)4-3-5-9(7)11/h3-5,12H,2,6H2,1H3
InChI Key:
OZMQDJXVZMXMAG-UHFFFAOYSA-N
SMILES:
CCNCc1c(F)cccc1F
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.086g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.191g/mol
Monoisotopic Mass:
171.086g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties