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Karbutilate

CAS No.:
4849-32-5
Catalog Number:
AG01FNZH
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01FNZH
Chemical Name:
Karbutilate
CAS Number:
4849-32-5
IUPAC Name:
[3-(dimethylcarbamoylamino)phenyl] N-tert-butylcarbamate
InChI:
InChI=1S/C14H21N3O3/c1-14(2,3)16-13(19)20-11-8-6-7-10(9-11)15-12(18)17(4)5/h6-9H,1-5H3,(H,15,18)(H,16,19)
InChI Key:
OWNAXTAAAQTBSP-UHFFFAOYSA-N
EC Number:
225-439-7
UNII:
49A0A2590D
NSC Number:
222508
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.158g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
279.34g/mol
Monoisotopic Mass:
279.158g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Importance of physicochemical properties for the design of new pesticides. Journal of agricultural and food chemistry 20110413
Photo-induced chemiluminometric determination of Karbutilate in a continuous-flow multicommutation assembly. Journal of pharmaceutical and biomedical analysis 20070117
Properties