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1443304-55-9 | 5-Fluoro-3-n-hexyloxybenzaldehyde
CAS No: 1443304-55-9 Catalog No: AG01FEFQ MDL No:
Product Description
Catalog Number:
AG01FEFQ
Chemical Name:
5-Fluoro-3-n-hexyloxybenzaldehyde
CAS Number:
1443304-55-9
Molecular Formula:
C13H17FO2
Molecular Weight:
224.2713
IUPAC Name:
3-fluoro-5-hexoxybenzaldehyde
InChI:
InChI=1S/C13H17FO2/c1-2-3-4-5-6-16-13-8-11(10-15)7-12(14)9-13/h7-10H,2-6H2,1H3
InChI Key:
CCNWDSFHPYCMLU-UHFFFAOYSA-N
SMILES:
CCCCCCOc1cc(F)cc(c1)C=O
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.275g/mol
Monoisotopic Mass:
224.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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