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Home > Aldehydes > 883512-11-6
883512-11-6 | 4-(4-benzyl-1-piperazino)-2-bromo-benzaldehyde
CAS No: 883512-11-6 Catalog No: AG0045DW MDL No:MFCD06656552
Product Description
Catalog Number:
AG0045DW
Chemical Name:
4-(4-benzyl-1-piperazino)-2-bromo-benzaldehyde
CAS Number:
883512-11-6
Molecular Formula:
C18H19BrN2O
Molecular Weight:
359.2603
MDL Number:
MFCD06656552
IUPAC Name:
4-(4-benzylpiperazin-1-yl)-2-bromobenzaldehyde
InChI:
InChI=1S/C18H19BrN2O/c19-18-12-17(7-6-16(18)14-22)21-10-8-20(9-11-21)13-15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2
InChI Key:
GAUATSZMWJVZQX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1Br)N1CCN(CC1)Cc1ccccc1
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.068g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
359.267g/mol
Monoisotopic Mass:
358.068g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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