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78877-20-0 | 6-Azaspiro[4.5]dec-1-ene,6-(phenylmethyl)-
CAS No: 78877-20-0 Catalog No: AG005D7V MDL No:
Product Description
Catalog Number:
AG005D7V
Chemical Name:
6-Azaspiro[4.5]dec-1-ene,6-(phenylmethyl)-
CAS Number:
78877-20-0
Molecular Formula:
C16H21N
Molecular Weight:
227.3446
IUPAC Name:
6-benzyl-6-azaspiro[4.5]dec-3-ene
InChI:
InChI=1S/C16H21N/c1-2-8-15(9-3-1)14-17-13-7-6-12-16(17)10-4-5-11-16/h1-4,8-10H,5-7,11-14H2
InChI Key:
RNYBWLXPBJWIAF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCCCC21CCC=C2
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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