Home Aminos 2-{[1-(2-fluorophenyl)ethyl]amino}-3-methylbutan-1-ol hydrochloride

2-{[1-(2-fluorophenyl)ethyl]amino}-3-methylbutan-1-ol hydrochloride

CAS No.:
1803583-20-1
Catalog Number:
AG01B9A6
Molecular Formula:
C13H21ClFNO
Molecular Weight:
261.7633
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Product Description
Catalog Number:
AG01B9A6
Chemical Name:
2-{[1-(2-fluorophenyl)ethyl]amino}-3-methylbutan-1-ol hydrochloride
CAS Number:
1803583-20-1
Molecular Formula:
C13H21ClFNO
Molecular Weight:
261.7633
MDL Number:
MFCD28348304
IUPAC Name:
2-[1-(2-fluorophenyl)ethylamino]-3-methylbutan-1-ol;hydrochloride
InChI:
InChI=1S/C13H20FNO.ClH/c1-9(2)13(8-16)15-10(3)11-6-4-5-7-12(11)14;/h4-7,9-10,13,15-16H,8H2,1-3H3;1H
InChI Key:
JWBIAASCXBSZGU-UHFFFAOYSA-N
SMILES:
OCC(C(C)C)NC(c1ccccc1F)C.Cl
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.13g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
261.765g/mol
Monoisotopic Mass:
261.13g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties