AG019F1X

90947-00-5 | (E)-5-(4-Iodobenzylidene)-2-thioxothiazolidin-4-one

AG019F1X

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	90947-00-5
Catalog Number	AG019F1X(AGN-PC-02GM4U)
Chemical Name	(E)-5-(4-Iodobenzylidene)-2-thioxothiazolidin-4-one
IUPAC Name	5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
InChI	InChI=1S/C10H6INOS2/c11-7-3-1-6(2-4-7)5-8-9(13)12-10(14)15-8/h1-5H,(H,12,13,14)
InChI Key	LIRUBCDZKKWCPS-UHFFFAOYSA-N
MDL Number	MFCD00449708
Molecular Formula	C10H6INOS2
Molecular Weight	347.1952
SMILES	O=C1NC(S/C1=CC2=CC=C(I)C=C2)=S
Synonyms	90947-00-5, (5Z)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, AC1MJ59K, AKOS030239324, MCULE-4841098794, 5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, NSC409012, CID3131573, (E)-5-(4-Iodobenzylidene)-2-thioxothiazolidin-4-one,

Complexity	321
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	346.894g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	347.188g/mol
Monoisotopic Mass	346.894g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	86.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number