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Home > Other Heterocycles > 78877-18-6
78877-18-6 | 1-benzyl-1-azaspiro[4.5]dec-9-ene
CAS No: 78877-18-6 Catalog No: AG005OXK MDL No:
Product Description
Catalog Number:
AG005OXK
Chemical Name:
1-benzyl-1-azaspiro[4.5]dec-9-ene
CAS Number:
78877-18-6
Molecular Formula:
C16H21N
Molecular Weight:
227.3446
IUPAC Name:
1-benzyl-1-azaspiro[4.5]dec-6-ene
InChI:
InChI=1S/C16H21N/c1-3-8-15(9-4-1)14-17-13-7-12-16(17)10-5-2-6-11-16/h1,3-5,8-10H,2,6-7,11-14H2
InChI Key:
JOLDDGFNJHXFJJ-UHFFFAOYSA-N
SMILES:
C1CCC2(C=C1)CCCN2Cc1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.167g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.351g/mol
Monoisotopic Mass:
227.167g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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