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Home > Aldehydes > 1378819-64-7
1378819-64-7 | 2-n-Butoxy-4-fluorobenzaldehyde
CAS No: 1378819-64-7 Catalog No: AG01FEVV MDL No:
Product Description
Catalog Number:
AG01FEVV
Chemical Name:
2-n-Butoxy-4-fluorobenzaldehyde
CAS Number:
1378819-64-7
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
IUPAC Name:
2-butoxy-4-fluorobenzaldehyde
InChI:
InChI=1S/C11H13FO2/c1-2-3-6-14-11-7-10(12)5-4-9(11)8-13/h4-5,7-8H,2-3,6H2,1H3
InChI Key:
KQMNWTYIHKRHAX-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(F)ccc1C=O
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.221g/mol
Monoisotopic Mass:
196.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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