Home Other Building Blocks ethyl 2-(4-carbamothioylphenoxy)acetate

ethyl 2-(4-carbamothioylphenoxy)acetate

CAS No.:
1017036-46-2
Catalog Number:
AG019TZR
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
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Product Description
Catalog Number:
AG019TZR
Chemical Name:
ethyl 2-(4-carbamothioylphenoxy)acetate
CAS Number:
1017036-46-2
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
MDL Number:
MFCD09936031
IUPAC Name:
ethyl 2-(4-carbamothioylphenoxy)acetate
InChI:
InChI=1S/C11H13NO3S/c1-2-14-10(13)7-15-9-5-3-8(4-6-9)11(12)16/h3-6H,2,7H2,1H3,(H2,12,16)
InChI Key:
LVFCIEJBJUHZIH-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ccc(cc1)C(=S)N
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.289g/mol
Monoisotopic Mass:
239.062g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
93.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties