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Home > Aldehydes > 1781648-59-6
1781648-59-6 | 3-Piperidinecarboxaldehyde, 1-phenyl-
CAS No: 1781648-59-6 Catalog No: AG0025SX MDL No:
Product Description
Catalog Number:
AG0025SX
Chemical Name:
3-Piperidinecarboxaldehyde, 1-phenyl-
CAS Number:
1781648-59-6
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
1-phenylpiperidine-3-carbaldehyde
InChI:
InChI=1S/C12H15NO/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2
InChI Key:
QJIWGJPOKYOJHB-UHFFFAOYSA-N
SMILES:
O=CC1CCCN(C1)c1ccccc1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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