Home Other Building Blocks 3-fluoro-4-(propan-2-yl)aniline

3-fluoro-4-(propan-2-yl)aniline

CAS No.:
1369809-48-2
Catalog Number:
AG01ABV4
Molecular Formula:
C9H12FN
Molecular Weight:
153.1967
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Product Description
Catalog Number:
AG01ABV4
Chemical Name:
3-fluoro-4-(propan-2-yl)aniline
CAS Number:
1369809-48-2
Molecular Formula:
C9H12FN
Molecular Weight:
153.1967
MDL Number:
MFCD21234657
IUPAC Name:
3-fluoro-4-propan-2-ylaniline
InChI:
InChI=1S/C9H12FN/c1-6(2)8-4-3-7(11)5-9(8)10/h3-6H,11H2,1-2H3
InChI Key:
GPKLGLANZUPGLT-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)F)C(C)C
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.095g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.2g/mol
Monoisotopic Mass:
153.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties