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84459-33-6 | Benzaldehyde,2-bromo-4-chloro-
CAS No: 84459-33-6 Catalog No: AG00550X MDL No:MFCD09056792
Product Description
Catalog Number:
AG00550X
Chemical Name:
Benzaldehyde,2-bromo-4-chloro-
CAS Number:
84459-33-6
Molecular Formula:
C7H4BrClO
Molecular Weight:
219.4631
MDL Number:
MFCD09056792
IUPAC Name:
2-bromo-4-chlorobenzaldehyde
InChI:
InChI=1S/C7H4BrClO/c8-7-3-6(9)2-1-5(7)4-10/h1-4H
InChI Key:
AJOAHIKYBSZIEV-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1Br)Cl
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.913g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.462g/mol
Monoisotopic Mass:
217.913g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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