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918524-00-2 | 4-(4'-Chlorobenzyloxy)-3-fluorobenzaldehyde
CAS No: 918524-00-2 Catalog No: AG01EZ99 MDL No:
Product Description
Catalog Number:
AG01EZ99
Chemical Name:
4-(4'-Chlorobenzyloxy)-3-fluorobenzaldehyde
CAS Number:
918524-00-2
Molecular Formula:
C14H10ClFO2
Molecular Weight:
264.6794
IUPAC Name:
4-[(4-chlorophenyl)methoxy]-3-fluorobenzaldehyde
InChI:
InChI=1S/C14H10ClFO2/c15-12-4-1-10(2-5-12)9-18-14-6-3-11(8-17)7-13(14)16/h1-8H,9H2
InChI Key:
RFQNYXIOWVNCHB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)OCc1ccc(cc1)Cl
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.035g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.68g/mol
Monoisotopic Mass:
264.035g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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