144940-73-8
3-CARBOXYMETHYL-5-[1-(3-METHYL-2-THIAZOLIDINYLIDENE)-2-PROPYLIDENE]RHODANINE SODIUM SALT
Name3-CARBOXYMETHYL-5-[1-(3-METHYL-2-THIAZOLIDINYLIDENE)-2-PROPYLIDENE]RHODANINE SODIUM SALT
FormulaC12 H13 N2 O3 S3 . Na
1Identification
【Name】
3-CARBOXYMETHYL-5-[1-(3-METHYL-2-THIAZOLIDINYLIDENE)-2-PROPYLIDENE]RHODANINE SODIUM SALT
【CAS】
【MDL】
MFCD01457280
【English Synonyms】
【Formula】
C12 H13 N2 O3 S3 . Na
【MolWeight】
352.434
【Inchi】
InChI=1S/C12H14N2O3S3.Na/c1-7(5-8-13(2)3-4-19-8)10-11(17)14(6-9(15)16)12(18)20-10;/h5H,3-4,6H2,1-2H3,(H,15,16);/q;+1/p-1/b8-5+,10-7+;
【InChIKey】
InChIKey=PKVRQWIDQPNCPF-GKSAIXJRSA-M
【SMILES】
C/C(=C\1/C(=O)N(C(=S)S1)CC(=O)[O-])/C=C/2\N(CCS2)C.[Na+]
【MOL File】
3-CARBOXYMETHYL-5-[1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-CARBOXYMETHYL-5-[1-(3-METHYL-2-THIAZOLIDINYLIDENE)-2-PROPYLIDENE]RHODANINE SODIUM SALT.cml