Home Other Building Blocks 2-Fluoro-N-isobutylbenzylamine, 97%

2-Fluoro-N-isobutylbenzylamine, 97%

CAS No.:
893589-79-2
Catalog Number:
AG003HC0
Molecular Formula:
C11H16FN
Molecular Weight:
181.2498
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Product Description
Catalog Number:
AG003HC0
Chemical Name:
2-Fluoro-N-isobutylbenzylamine, 97%
CAS Number:
893589-79-2
Molecular Formula:
C11H16FN
Molecular Weight:
181.2498
MDL Number:
MFCD04510051
IUPAC Name:
N-[(2-fluorophenyl)methyl]-2-methylpropan-1-amine
InChI:
InChI=1S/C11H16FN/c1-9(2)7-13-8-10-5-3-4-6-11(10)12/h3-6,9,13H,7-8H2,1-2H3
InChI Key:
MXIQSNZZFFIORF-UHFFFAOYSA-N
SMILES:
CC(CNCc1ccccc1F)C
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.127g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.254g/mol
Monoisotopic Mass:
181.127g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties