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61157-70-8 | 3,4-Dihydro-2H-pyridine-1-carbaldehyde
CAS No: 61157-70-8 Catalog No: AG01EWNC MDL No:
Product Description
Catalog Number:
AG01EWNC
Chemical Name:
3,4-Dihydro-2H-pyridine-1-carbaldehyde
CAS Number:
61157-70-8
Molecular Formula:
C6H9NO
Molecular Weight:
111.1418
IUPAC Name:
3,4-dihydro-2H-pyridine-1-carbaldehyde
InChI:
InChI=1S/C6H9NO/c8-6-7-4-2-1-3-5-7/h2,4,6H,1,3,5H2
InChI Key:
IMUULUQUUGIQCO-UHFFFAOYSA-N
SMILES:
C1CCC=CN1C=O
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.144g/mol
Monoisotopic Mass:
111.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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