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73777-70-5 | 1-Piperidinecarboxaldehyde, 2-(2-oxopropyl)-
CAS No: 73777-70-5 Catalog No: AG005X8E MDL No:
Product Description
Catalog Number:
AG005X8E
Chemical Name:
1-Piperidinecarboxaldehyde, 2-(2-oxopropyl)-
CAS Number:
73777-70-5
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
IUPAC Name:
2-(2-oxopropyl)piperidine-1-carbaldehyde
InChI:
InChI=1S/C9H15NO2/c1-8(12)6-9-4-2-3-5-10(9)7-11/h7,9H,2-6H2,1H3
InChI Key:
ACCIPUGMVRIIAO-UHFFFAOYSA-N
SMILES:
O=CN1CCCCC1CC(=O)C
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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