Home Nitriles 4-(1-aminoethyl)-3-fluorobenzonitrile hydrochloride

4-(1-aminoethyl)-3-fluorobenzonitrile hydrochloride

CAS No.:
1461706-66-0
Catalog Number:
AG01A71Q
Molecular Formula:
C9H10ClFN2
Molecular Weight:
200.6405
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Product Description
Catalog Number:
AG01A71Q
Chemical Name:
4-(1-aminoethyl)-3-fluorobenzonitrile hydrochloride
CAS Number:
1461706-66-0
Molecular Formula:
C9H10ClFN2
Molecular Weight:
200.6405
MDL Number:
MFCD25970509
IUPAC Name:
4-(1-aminoethyl)-3-fluorobenzonitrile;hydrochloride
InChI:
InChI=1S/C9H9FN2.ClH/c1-6(12)8-3-2-7(5-11)4-9(8)10;/h2-4,6H,12H2,1H3;1H
InChI Key:
IPHUUNLWRXSURM-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)F)C(N)C.Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.052g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.641g/mol
Monoisotopic Mass:
200.052g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties