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BENZTHIAZURON

CAS No.:
1929-88-0
Catalog Number:
AG00APM1
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
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Product Description
Catalog Number:
AG00APM1
Chemical Name:
BENZTHIAZURON
CAS Number:
1929-88-0
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
MDL Number:
MFCD00055363
IUPAC Name:
1-(1,3-benzothiazol-2-yl)-3-methylurea
InChI:
InChI=1S/C9H9N3OS/c1-10-8(13)12-9-11-6-4-2-3-5-7(6)14-9/h2-5H,1H3,(H2,10,11,12,13)
InChI Key:
DTCJYIIKPVRVDD-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1nc2c(s1)cccc2
EC Number:
217-685-9
UNII:
I9612759PA
NSC Number:
202513
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Efficient degradation of methabenzthiazuron photoinduced by decatungstate anion in water: kinetics and mechanistic studies. Chemosphere 20111001
Determination of benzimidazole anthelmintics in animal-derived biological matrices. Annali di chimica 20020401
Properties