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Home > Other Heterocycles > 78877-19-7
78877-19-7 | 1-benzyl-1-azaspiro[4.4]non-6-ene
CAS No: 78877-19-7 Catalog No: AG005D7W MDL No:
Product Description
Catalog Number:
AG005D7W
Chemical Name:
1-benzyl-1-azaspiro[4.4]non-6-ene
CAS Number:
78877-19-7
Molecular Formula:
C15H19N
Molecular Weight:
213.3181
IUPAC Name:
1-benzyl-1-azaspiro[4.4]non-8-ene
InChI:
InChI=1S/C15H19N/c1-2-7-14(8-3-1)13-16-12-6-11-15(16)9-4-5-10-15/h1-4,7-9H,5-6,10-13H2
InChI Key:
QJBLDLFYCYRBLK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCCC21C=CCC2
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.324g/mol
Monoisotopic Mass:
213.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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