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1189960-20-0 | 2-n-Butyl-d3-1,3-diazaspiro[4.4]non-1-en-4-one
CAS No: 1189960-20-0 Catalog No: AG01E002 MDL No:
Product Description
Catalog Number:
AG01E002
Chemical Name:
2-n-Butyl-d3-1,3-diazaspiro[4.4]non-1-en-4-one
CAS Number:
1189960-20-0
IUPAC Name:
2-(4,4,4-trideuteriobutyl)-1,3-diazaspiro[4.4]non-1-en-4-one
InChI:
InChI=1S/C11H18N2O/c1-2-3-6-9-12-10(14)11(13-9)7-4-5-8-11/h2-8H2,1H3,(H,12,13,14)/i1D3
InChI Key:
IWKWOYOVCXHXSS-FIBGUPNXSA-N
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.161g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
3
Molecular Weight:
197.296g/mol
Monoisotopic Mass:
197.161g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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