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Home > Other Heterocycles > 918896-22-7
918896-22-7 | 1,9-Diazaspiro[5.5]undec-3-ene, 3-methyl-9-(phenylmethyl)-
CAS No: 918896-22-7 Catalog No: AG006MGE MDL No:
Product Description
Catalog Number:
AG006MGE
Chemical Name:
1,9-Diazaspiro[5.5]undec-3-ene, 3-methyl-9-(phenylmethyl)-
CAS Number:
918896-22-7
Molecular Formula:
C17H24N2
Molecular Weight:
256.3859
IUPAC Name:
9-benzyl-3-methyl-1,9-diazaspiro[5.5]undec-3-ene
InChI:
InChI=1S/C17H24N2/c1-15-7-8-17(18-13-15)9-11-19(12-10-17)14-16-5-3-2-4-6-16/h2-7,18H,8-14H2,1H3
InChI Key:
BRNMSADFBFRSCC-UHFFFAOYSA-N
SMILES:
CC1=CCC2(NC1)CCN(CC2)Cc1ccccc1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.194g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.393g/mol
Monoisotopic Mass:
256.194g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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