Home Aldehydes 2-(4-Bromophenyl)malonaldehyde

2-(4-Bromophenyl)malonaldehyde

CAS No.:
709648-68-0
Catalog Number:
AG005FK6
Molecular Formula:
C9H7BrO2
Molecular Weight:
227.0547
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Product Description
Catalog Number:
AG005FK6
Chemical Name:
2-(4-Bromophenyl)malonaldehyde
CAS Number:
709648-68-0
Molecular Formula:
C9H7BrO2
Molecular Weight:
227.0547
MDL Number:
MFCD07776173
IUPAC Name:
2-(4-bromophenyl)propanedial
InChI:
InChI=1S/C9H7BrO2/c10-9-3-1-7(2-4-9)8(5-11)6-12/h1-6,8H
InChI Key:
PRLAEKVWSOXWMG-UHFFFAOYSA-N
SMILES:
O=CC(c1ccc(cc1)Br)C=O
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.963g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.057g/mol
Monoisotopic Mass:
225.963g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties