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Home > Aldehydes > 819076-48-7
819076-48-7 | Benzaldehyde, 2,6-dimethoxy-4-[(2,4,6-trifluorophenyl)methoxy]-
CAS No: 819076-48-7 Catalog No: AG0055WX MDL No:
Product Description
Catalog Number:
AG0055WX
Chemical Name:
Benzaldehyde, 2,6-dimethoxy-4-[(2,4,6-trifluorophenyl)methoxy]-
CAS Number:
819076-48-7
Molecular Formula:
C16H13F3O4
Molecular Weight:
326.2672
IUPAC Name:
2,6-dimethoxy-4-[(2,4,6-trifluorophenyl)methoxy]benzaldehyde
InChI:
InChI=1S/C16H13F3O4/c1-21-15-5-10(6-16(22-2)11(15)7-20)23-8-12-13(18)3-9(17)4-14(12)19/h3-7H,8H2,1-2H3
InChI Key:
GBXZMBNDFZTQLU-UHFFFAOYSA-N
SMILES:
COc1cc(OCc2c(F)cc(cc2F)F)cc(c1C=O)OC
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.077g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.271g/mol
Monoisotopic Mass:
326.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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