Home Aminos 2-[(Thiazolidin-2-ylidene)aminomethylidene]malonic acid

2-[(Thiazolidin-2-ylidene)aminomethylidene]malonic acid

CAS No.:
1820748-73-9
Catalog Number:
AG00I15E
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$250
- +
5g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00I15E
Chemical Name:
2-[(Thiazolidin-2-ylidene)aminomethylidene]malonic acid
CAS Number:
1820748-73-9
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
MDL Number:
MFCD27981331
IUPAC Name:
2-[(4,5-dihydro-1,3-thiazol-2-ylamino)methylidene]propanedioic acid
InChI:
InChI=1S/C7H8N2O4S/c10-5(11)4(6(12)13)3-9-7-8-1-2-14-7/h3H,1-2H2,(H,8,9)(H,10,11)(H,12,13)
InChI Key:
CYBJMBDYGDZDLY-UHFFFAOYSA-N
SMILES:
OC(=O)C(=C/N=C\1/NCCS1)C(=O)O
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
216.211g/mol
Monoisotopic Mass:
216.02g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties