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Home > Aldehydes > 891844-09-0
891844-09-0 | 3-bromo-5-ethyl-2-fluorobenzaldehyde
CAS No: 891844-09-0 Catalog No: AG01DD0Q MDL No:MFCD27931630
Product Description
Catalog Number:
AG01DD0Q
Chemical Name:
3-bromo-5-ethyl-2-fluorobenzaldehyde
CAS Number:
891844-09-0
Molecular Formula:
C9H8BrFO
Molecular Weight:
231.0616
MDL Number:
MFCD27931630
IUPAC Name:
3-bromo-5-ethyl-2-fluorobenzaldehyde
InChI:
InChI=1S/C9H8BrFO/c1-2-6-3-7(5-12)9(11)8(10)4-6/h3-5H,2H2,1H3
InChI Key:
KBMGKCHCYMBTMA-UHFFFAOYSA-N
SMILES:
CCc1cc(C=O)c(c(c1)Br)F
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.974g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.064g/mol
Monoisotopic Mass:
229.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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