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Home > Fluorides > 1233955-81-1
1233955-81-1 | 2-Fluoro-6-(pentan-3-yloxy)aniline
CAS No: 1233955-81-1 Catalog No: AG01FE3R MDL No:
Product Description
Catalog Number:
AG01FE3R
Chemical Name:
2-Fluoro-6-(pentan-3-yloxy)aniline
CAS Number:
1233955-81-1
Molecular Formula:
C11H16FNO
Molecular Weight:
197.2492
IUPAC Name:
2-fluoro-6-pentan-3-yloxyaniline
InChI:
InChI=1S/C11H16FNO/c1-3-8(4-2)14-10-7-5-6-9(12)11(10)13/h5-8H,3-4,13H2,1-2H3
InChI Key:
CLBLFUTYTUMTJM-UHFFFAOYSA-N
SMILES:
CCC(Oc1cccc(c1N)F)CC
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.122g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.253g/mol
Monoisotopic Mass:
197.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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