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Home > Other Heterocycles > 90137-50-1
90137-50-1 | Bicyclo[2.2.1]hepta-2,5-diene-2-carboxamide, N-2-naphthalenyl-
CAS No: 90137-50-1 Catalog No: AG00H71X MDL No:
Product Description
Catalog Number:
AG00H71X
Chemical Name:
Bicyclo[2.2.1]hepta-2,5-diene-2-carboxamide, N-2-naphthalenyl-
CAS Number:
90137-50-1
Molecular Formula:
C18H15NO
Molecular Weight:
261.3178
IUPAC Name:
N-naphthalen-2-ylbicyclo[2.2.1]hepta-2,5-diene-2-carboxamide
InChI:
InChI=1S/C18H15NO/c20-18(17-10-12-5-6-15(17)9-12)19-16-8-7-13-3-1-2-4-14(13)11-16/h1-8,10-12,15H,9H2,(H,19,20)
InChI Key:
AQHQOYLIKRZZMS-UHFFFAOYSA-N
SMILES:
O=C(C1=CC2CC1C=C2)Nc1ccc2c(c1)cccc2
Properties
Complexity:
464
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.115g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.324g/mol
Monoisotopic Mass:
261.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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