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Home > Fluorides > 1233955-18-4
1233955-18-4 | 5-Fluoro-2-(pentan-3-yloxy)aniline
CAS No: 1233955-18-4 Catalog No: AG01FE3Q MDL No:
Product Description
Catalog Number:
AG01FE3Q
Chemical Name:
5-Fluoro-2-(pentan-3-yloxy)aniline
CAS Number:
1233955-18-4
Molecular Formula:
C11H16FNO
Molecular Weight:
197.2492
IUPAC Name:
5-fluoro-2-pentan-3-yloxyaniline
InChI:
InChI=1S/C11H16FNO/c1-3-9(4-2)14-11-6-5-8(12)7-10(11)13/h5-7,9H,3-4,13H2,1-2H3
InChI Key:
VFIPXYGRVPGQPC-UHFFFAOYSA-N
SMILES:
CCC(Oc1ccc(cc1N)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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