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Home Other Building Blocks 1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one

1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one

CAS No.:
1021-25-6
Catalog Number:
AG0006MM
Molecular Formula:
C13H17N3O
Molecular Weight:
231.2936
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$563
- +
10g
95%
In Stock USA
United States
$1063
- +
Product Description
Catalog Number:
AG0006MM
Chemical Name:
1-Phenyl-1,3,8-triazaspiro[4.5]decan-4-one
CAS Number:
1021-25-6
Molecular Formula:
C13H17N3O
Molecular Weight:
231.2936
MDL Number:
MFCD00005977
IUPAC Name:
1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
InChI:
InChI=1S/C13H17N3O/c17-12-13(6-8-14-9-7-13)16(10-15-12)11-4-2-1-3-5-11/h1-5,14H,6-10H2,(H,15,17)
InChI Key:
HTQWGIHCFPWKAS-UHFFFAOYSA-N
SMILES:
O=C1NCN(C21CCNCC2)c1ccccc1
EC Number:
213-819-5
NSC Number:
96918
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.137g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.299g/mol
Monoisotopic Mass:
231.137g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties