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Home > Other Heterocycles > 87703-67-1
87703-67-1 | 1,4,8-Triazaspiro[4.5]dec-1-ene, 2,3,3,7,7,9,9-heptamethyl-, 1-oxide
CAS No: 87703-67-1 Catalog No: AG004NCG MDL No:
Product Description
Catalog Number:
AG004NCG
Chemical Name:
1,4,8-Triazaspiro[4.5]dec-1-ene, 2,3,3,7,7,9,9-heptamethyl-, 1-oxide
CAS Number:
87703-67-1
Molecular Formula:
C14H27N3O
Molecular Weight:
253.3837
IUPAC Name:
2,2,3,7,7,9,9-heptamethyl-4-oxido-1,8-diaza-4-azoniaspiro[4.5]dec-3-ene
InChI:
InChI=1S/C14H27N3O/c1-10-13(6,7)16-14(17(10)18)8-11(2,3)15-12(4,5)9-14/h15-16H,8-9H2,1-7H3
InChI Key:
FFGUSWHGADBDIF-UHFFFAOYSA-N
SMILES:
CC1=[N+]([O-])C2(NC1(C)C)CC(C)(C)NC(C2)(C)C
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.215g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.39g/mol
Monoisotopic Mass:
253.215g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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