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Home > Aldehydes > 126344-05-6
126344-05-6 | 1-Azabicyclo[2.2.1]heptane-4-carboxaldehyde
CAS No: 126344-05-6 Catalog No: AG000SPJ MDL No:
Product Description
Catalog Number:
AG000SPJ
Chemical Name:
1-Azabicyclo[2.2.1]heptane-4-carboxaldehyde
CAS Number:
126344-05-6
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
IUPAC Name:
1-azabicyclo[2.2.1]heptane-4-carbaldehyde
InChI:
InChI=1S/C7H11NO/c9-6-7-1-3-8(5-7)4-2-7/h6H,1-5H2
InChI Key:
KRXFNXMCMSUEOM-UHFFFAOYSA-N
SMILES:
O=CC12CCN(C2)CC1
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.171g/mol
Monoisotopic Mass:
125.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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