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Home > Aldehydes > 1784109-49-4
1784109-49-4 | 3-Bromo-2-ethoxy-5-fluorobenzaldehyde
CAS No: 1784109-49-4 Catalog No: AG01FD8J MDL No:MFCD28396358
Product Description
Catalog Number:
AG01FD8J
Chemical Name:
3-Bromo-2-ethoxy-5-fluorobenzaldehyde
CAS Number:
1784109-49-4
Molecular Formula:
C9H8BrFO2
Molecular Weight:
247.0610
MDL Number:
MFCD28396358
IUPAC Name:
3-bromo-2-ethoxy-5-fluorobenzaldehyde
InChI:
InChI=1S/C9H8BrFO2/c1-2-13-9-6(5-12)3-7(11)4-8(9)10/h3-5H,2H2,1H3
InChI Key:
ZEOBCTFUICCGBK-UHFFFAOYSA-N
SMILES:
CCOc1c(Br)cc(cc1C=O)F
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.969g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.063g/mol
Monoisotopic Mass:
245.969g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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