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Home > Aldehydes > 1381944-64-4
1381944-64-4 | Benzaldehyde, 2-bromo-6-(4-methyl-1-piperazinyl)-
CAS No: 1381944-64-4 Catalog No: AG00186H MDL No:MFCD22375103
Product Description
Catalog Number:
AG00186H
Chemical Name:
Benzaldehyde, 2-bromo-6-(4-methyl-1-piperazinyl)-
CAS Number:
1381944-64-4
Molecular Formula:
C12H15BrN2O
Molecular Weight:
283.1643
MDL Number:
MFCD22375103
IUPAC Name:
2-bromo-6-(4-methylpiperazin-1-yl)benzaldehyde
InChI:
InChI=1S/C12H15BrN2O/c1-14-5-7-15(8-6-14)12-4-2-3-11(13)10(12)9-16/h2-4,9H,5-8H2,1H3
InChI Key:
SKXRXIOFWRSMCH-UHFFFAOYSA-N
SMILES:
O=Cc1c(Br)cccc1N1CCN(CC1)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.037g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.169g/mol
Monoisotopic Mass:
282.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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