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2967-92-2 | Benzaldehyde, 4-(2-fluoroethoxy)-
CAS No: 2967-92-2 Catalog No: AG002Z1K MDL No:
Product Description
Catalog Number:
AG002Z1K
Chemical Name:
Benzaldehyde, 4-(2-fluoroethoxy)-
CAS Number:
2967-92-2
Molecular Formula:
C9H9FO2
Molecular Weight:
168.1650
IUPAC Name:
4-(2-fluoroethoxy)benzaldehyde
InChI:
InChI=1S/C9H9FO2/c10-5-6-12-9-3-1-8(7-11)2-4-9/h1-4,7H,5-6H2
InChI Key:
INJGNPMZUJFVFK-UHFFFAOYSA-N
SMILES:
FCCOc1ccc(cc1)C=O
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.167g/mol
Monoisotopic Mass:
168.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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