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2044714-57-8 | 5-bromo-2-fluoro-4-[1-(methoxymethoxy)ethyl]benzaldehyde
CAS No: 2044714-57-8 Catalog No: AG01BXIU MDL No:MFCD30487826
Product Description
Catalog Number:
AG01BXIU
Chemical Name:
5-bromo-2-fluoro-4-[1-(methoxymethoxy)ethyl]benzaldehyde
CAS Number:
2044714-57-8
Molecular Formula:
C11H12BrFO3
Molecular Weight:
291.1136
MDL Number:
MFCD30487826
IUPAC Name:
5-bromo-2-fluoro-4-[1-(methoxymethoxy)ethyl]benzaldehyde
InChI:
InChI=1S/C11H12BrFO3/c1-7(16-6-15-2)9-4-11(13)8(5-14)3-10(9)12/h3-5,7H,6H2,1-2H3
InChI Key:
HLUKUGPZGLPNSH-UHFFFAOYSA-N
SMILES:
CC(c1cc(F)c(cc1Br)C=O)OCOC
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.995g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.116g/mol
Monoisotopic Mass:
289.995g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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