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1956426-40-6 | (Z)-tert-Butyl (3-methyl-4-oxo-1,3,8-triazaspiro[4.5]decan-2-ylidene)carbamate oxalate
CAS No: 1956426-40-6 Catalog No: AG00I3JE MDL No:
Product Description
Catalog Number:
AG00I3JE
Chemical Name:
(Z)-tert-Butyl (3-methyl-4-oxo-1,3,8-triazaspiro[4.5]decan-2-ylidene)carbamate oxalate
CAS Number:
1956426-40-6
IUPAC Name:
tert-butyl N-(3-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-en-2-yl)carbamate;oxalic acid
InChI:
InChI=1S/C13H22N4O3.C2H2O4/c1-12(2,3)20-11(19)15-10-16-13(9(18)17(10)4)5-7-14-8-6-13;3-1(4)2(5)6/h14H,5-8H2,1-4H3,(H,15,16,19);(H,3,4)(H,5,6)
InChI Key:
YDUSSLXUWRLOQQ-UHFFFAOYSA-N
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.164g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
372.378g/mol
Monoisotopic Mass:
372.164g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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