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Home > Other Heterocycles > 1851512-69-0
1851512-69-0 | N-benzyl-7-oxabicyclo[2.2.1]heptane-2-carboxamide
CAS No: 1851512-69-0 Catalog No: AG01C7Y4 MDL No:MFCD31440274
Product Description
Catalog Number:
AG01C7Y4
Chemical Name:
N-benzyl-7-oxabicyclo[2.2.1]heptane-2-carboxamide
CAS Number:
1851512-69-0
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
MDL Number:
MFCD31440274
IUPAC Name:
N-benzyl-7-oxabicyclo[2.2.1]heptane-2-carboxamide
InChI:
InChI=1S/C14H17NO2/c16-14(12-8-11-6-7-13(12)17-11)15-9-10-4-2-1-3-5-10/h1-5,11-13H,6-9H2,(H,15,16)
InChI Key:
GKISAEGSBCVXMS-UHFFFAOYSA-N
SMILES:
O=C(C1CC2OC1CC2)NCc1ccccc1
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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