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Home > Other Heterocycles > 2060041-90-7
2060041-90-7 | 2,5,8-triazaspiro[3.6]decan-9-one
CAS No: 2060041-90-7 Catalog No: AG01BYMR MDL No:MFCD30535657
Product Description
Catalog Number:
AG01BYMR
Chemical Name:
2,5,8-triazaspiro[3.6]decan-9-one
CAS Number:
2060041-90-7
Molecular Formula:
C7H13N3O
Molecular Weight:
155.1976
MDL Number:
MFCD30535657
IUPAC Name:
2,5,8-triazaspiro[3.6]decan-9-one
InChI:
InChI=1S/C7H13N3O/c11-6-3-7(4-8-5-7)10-2-1-9-6/h8,10H,1-5H2,(H,9,11)
InChI Key:
LGKDCQIMOXDEHF-UHFFFAOYSA-N
SMILES:
O=C1NCCNC2(C1)CNC2
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.106g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
155.201g/mol
Monoisotopic Mass:
155.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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