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Home Carbonyls 4-(4-Ethoxycarbonylphenyl)-3-thiosemicarbazide

4-(4-Ethoxycarbonylphenyl)-3-thiosemicarbazide

CAS No.:
70619-50-0
Catalog Number:
AG00FCMS
Molecular Formula:
C10H13N3O2S
Molecular Weight:
239.2941
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$40
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Product Description
Catalog Number:
AG00FCMS
Chemical Name:
4-(4-Ethoxycarbonylphenyl)-3-thiosemicarbazide
CAS Number:
70619-50-0
Molecular Formula:
C10H13N3O2S
Molecular Weight:
239.2941
MDL Number:
MFCD00079754
IUPAC Name:
ethyl 4-(aminocarbamothioylamino)benzoate
InChI:
InChI=1S/C10H13N3O2S/c1-2-15-9(14)7-3-5-8(6-4-7)12-10(16)13-11/h3-6H,2,11H2,1H3,(H2,12,13,16)
InChI Key:
AFWIXYFUAGZASP-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)NC(=S)NN
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.073g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
239.293g/mol
Monoisotopic Mass:
239.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
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