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Home > Fluorides > 1379037-22-5
1379037-22-5 | 4-(4-Fluoro-2-methyl-phenoxy)butanenitrile
CAS No: 1379037-22-5 Catalog No: AG01FB9L MDL No:
Product Description
Catalog Number:
AG01FB9L
Chemical Name:
4-(4-Fluoro-2-methyl-phenoxy)butanenitrile
CAS Number:
1379037-22-5
Molecular Formula:
C11H12FNO
Molecular Weight:
193.2175
IUPAC Name:
4-(4-fluoro-2-methylphenoxy)butanenitrile
InChI:
InChI=1S/C11H12FNO/c1-9-8-10(12)4-5-11(9)14-7-3-2-6-13/h4-5,8H,2-3,7H2,1H3
InChI Key:
UEZZBIHKAVIURO-UHFFFAOYSA-N
SMILES:
N#CCCCOc1ccc(cc1C)F
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.221g/mol
Monoisotopic Mass:
193.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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