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Home > Other Heterocycles > 1368527-91-6
1368527-91-6 | 1-methyl-1,3,8-triazaspiro[4.5]decan-2-one
CAS No: 1368527-91-6 Catalog No: AG01B18S MDL No:MFCD21875104
Product Description
Catalog Number:
AG01B18S
Chemical Name:
1-methyl-1,3,8-triazaspiro[4.5]decan-2-one
CAS Number:
1368527-91-6
Molecular Formula:
C8H15N3O
Molecular Weight:
169.2242
MDL Number:
MFCD21875104
IUPAC Name:
1-methyl-1,3,8-triazaspiro[4.5]decan-2-one
InChI:
InChI=1S/C8H15N3O/c1-11-7(12)10-6-8(11)2-4-9-5-3-8/h9H,2-6H2,1H3,(H,10,12)
InChI Key:
GIHYAWRCQRJWNV-UHFFFAOYSA-N
SMILES:
O=C1NCC2(N1C)CCNCC2
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.122g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.228g/mol
Monoisotopic Mass:
169.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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