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Home > Aldehydes > 171881-36-0
171881-36-0 | 5-Bromo-2-(dimethylamino);benzaldehyde
CAS No: 171881-36-0 Catalog No: AG007WA4 MDL No:MFCD20529529
Product Description
Catalog Number:
AG007WA4
Chemical Name:
5-Bromo-2-(dimethylamino);benzaldehyde
CAS Number:
171881-36-0
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
MDL Number:
MFCD20529529
IUPAC Name:
5-bromo-2-(dimethylamino)benzaldehyde
InChI:
InChI=1S/C9H10BrNO/c1-11(2)9-4-3-8(10)5-7(9)6-12/h3-6H,1-2H3
InChI Key:
KELBDTNCLYIYKB-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)ccc1N(C)C
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.995g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.089g/mol
Monoisotopic Mass:
226.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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