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Home > Fluorides > 1233955-46-8
1233955-46-8 | 2-Fluoro-6-(neopentyloxy)aniline
CAS No: 1233955-46-8 Catalog No: AG01FELY MDL No:
Product Description
Catalog Number:
AG01FELY
Chemical Name:
2-Fluoro-6-(neopentyloxy)aniline
CAS Number:
1233955-46-8
Molecular Formula:
C11H16FNO
Molecular Weight:
197.2492
IUPAC Name:
2-(2,2-dimethylpropoxy)-6-fluoroaniline
InChI:
InChI=1S/C11H16FNO/c1-11(2,3)7-14-9-6-4-5-8(12)10(9)13/h4-6H,7,13H2,1-3H3
InChI Key:
DYMSNPCRKBTMNU-UHFFFAOYSA-N
SMILES:
CC(COc1cccc(c1N)F)(C)C
Properties
Complexity:
179
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:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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