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Home > Aldehydes > 888504-22-1
888504-22-1 | 3-(4-Bromo-2-fluorobenzyloxy)benzaldehyde
CAS No: 888504-22-1 Catalog No: AG01EYIL MDL No:
Product Description
Catalog Number:
AG01EYIL
Chemical Name:
3-(4-Bromo-2-fluorobenzyloxy)benzaldehyde
CAS Number:
888504-22-1
Molecular Formula:
C14H10BrFO2
Molecular Weight:
309.1304
IUPAC Name:
3-[(4-bromo-2-fluorophenyl)methoxy]benzaldehyde
InChI:
InChI=1S/C14H10BrFO2/c15-12-5-4-11(14(16)7-12)9-18-13-3-1-2-10(6-13)8-17/h1-8H,9H2
InChI Key:
CBRBADJDYCMRLI-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCc1ccc(cc1F)Br
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.985g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.134g/mol
Monoisotopic Mass:
307.985g/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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