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77771-02-9 | 3-Bromo-4-Fluorobenzaldehyde
CAS No: 77771-02-9 Catalog No: AG0033M6 MDL No:MFCD00042186
Product Description
Catalog Number:
AG0033M6
Chemical Name:
3-Bromo-4-Fluorobenzaldehyde
CAS Number:
77771-02-9
Molecular Formula:
C7H4BrFO
Molecular Weight:
203.0085
MDL Number:
MFCD00042186
IUPAC Name:
3-bromo-4-fluorobenzaldehyde
InChI:
InChI=1S/C7H4BrFO/c8-6-3-5(4-10)1-2-7(6)9/h1-4H
InChI Key:
FAHZIKXYYRGSHF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Br)F
EC Number:
278-764-1
UNII:
O61072992O
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.943g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.01g/mol
Monoisotopic Mass:
201.943g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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