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1443312-88-6 | 5-Fluoro-3-n-pentoxybenzaldehyde
CAS No: 1443312-88-6 Catalog No: AG01FEPJ MDL No:
Product Description
Catalog Number:
AG01FEPJ
Chemical Name:
5-Fluoro-3-n-pentoxybenzaldehyde
CAS Number:
1443312-88-6
Molecular Formula:
C12H15FO2
Molecular Weight:
210.2447
IUPAC Name:
3-fluoro-5-pentoxybenzaldehyde
InChI:
InChI=1S/C12H15FO2/c1-2-3-4-5-15-12-7-10(9-14)6-11(13)8-12/h6-9H,2-5H2,1H3
InChI Key:
KSFPDHUHDPKSED-UHFFFAOYSA-N
SMILES:
CCCCCOc1cc(F)cc(c1)C=O
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.248g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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