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Home > Aldehydes > 336879-99-3
336879-99-3 | 3-((2-Chloro-6-fluorobenzyl);oxy);benzaldehyde
CAS No: 336879-99-3 Catalog No: AG003IRB MDL No:MFCD01590673
Product Description
Catalog Number:
AG003IRB
Chemical Name:
3-((2-Chloro-6-fluorobenzyl);oxy);benzaldehyde
CAS Number:
336879-99-3
Molecular Formula:
C14H10ClFO2
Molecular Weight:
264.6794
MDL Number:
MFCD01590673
IUPAC Name:
3-[(2-chloro-6-fluorophenyl)methoxy]benzaldehyde
InChI:
InChI=1S/C14H10ClFO2/c15-13-5-2-6-14(16)12(13)9-18-11-4-1-3-10(7-11)8-17/h1-8H,9H2
InChI Key:
MOKRNGGWFAYLOD-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCc1c(F)cccc1Cl
Properties
Complexity:
275
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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