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870703-56-3 | 1-(3-Formylphenyl)piperazine
CAS No: 870703-56-3 Catalog No: AG003CX3 MDL No:MFCD07369775
Product Description
Catalog Number:
AG003CX3
Chemical Name:
1-(3-Formylphenyl)piperazine
CAS Number:
870703-56-3
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
MDL Number:
MFCD07369775
IUPAC Name:
3-piperazin-1-ylbenzaldehyde
InChI:
InChI=1S/C11H14N2O/c14-9-10-2-1-3-11(8-10)13-6-4-12-5-7-13/h1-3,8-9,12H,4-7H2
InChI Key:
RZLIVHYKFDFVNK-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)N1CCNCC1
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.246g/mol
Monoisotopic Mass:
190.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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