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2060063-84-3 | 4-(4-aminopiperidin-1-yl)benzaldehyde
CAS No: 2060063-84-3 Catalog No: AG01BWD3 MDL No:MFCD30476999
Product Description
Catalog Number:
AG01BWD3
Chemical Name:
4-(4-aminopiperidin-1-yl)benzaldehyde
CAS Number:
2060063-84-3
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
MDL Number:
MFCD30476999
IUPAC Name:
4-(4-aminopiperidin-1-yl)benzaldehyde
InChI:
InChI=1S/C12H16N2O/c13-11-5-7-14(8-6-11)12-3-1-10(9-15)2-4-12/h1-4,9,11H,5-8,13H2
InChI Key:
FTOOVYPYMQWAKH-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)N1CCC(CC1)N
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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