Home Other Building Blocks 2-[(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

2-[(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

CAS No.:
82159-09-9
Catalog Number:
AG0036GD
Molecular Formula:
C15H13NO3S2
Molecular Weight:
319.3986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$25
- +
5g
97%
In Stock USA
United States
$88
- +
10g
97%
In Stock USA
United States
$150
- +
25g
97%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0036GD
Chemical Name:
2-[(5Z)-5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
CAS Number:
82159-09-9
Molecular Formula:
C15H13NO3S2
Molecular Weight:
319.3986
MDL Number:
MFCD00865484
IUPAC Name:
2-[(5Z)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
InChI:
InChI=1S/C15H13NO3S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(19)16(9-13(17)18)15(20)21-12/h2-8H,9H2,1H3,(H,17,18)/b10-7+,12-8-
InChI Key:
CHNUOJQWGUIOLD-NFZZJPOKSA-N
SMILES:
C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)CC(=O)O
UNII:
424DV0807X
Properties
Complexity:
519  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2  
Exact Mass:
319.034g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
319.393g/mol
Monoisotopic Mass:
319.034g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
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Properties