AG003IZ0

10574-69-3 | 3-Benzyl-2-thioxothiazolidin-4-one

AG003IZ0

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CAS Number	10574-69-3
Catalog Number	AG003IZ0(AGN-PC-0JM2MY)
Chemical Name	3-Benzyl-2-thioxothiazolidin-4-one
IUPAC Name	3-benzyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI	InChI=1S/C10H9NOS2/c12-9-7-14-10(13)11(9)6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key	ZFHVUMCTGGAWBM-UHFFFAOYSA-N
MDL Number	MFCD00086924
Molecular Formula	C10H9NOS2
Molecular Weight	223.3146
NSC Number	142477
SMILES	S=C(N1CC2=CC=CC=C2)SCC1=O
Synonyms	3-Benzylrhodanine, 10574-69-3, N-Benzylrhodanine, Rhodanine, 3-benzyl-, 3-benzyl-2-thioxothiazolidin-4-one, 3-Benzyl-2-thioxo-1,3-thiazolidin-4-one, 4-Thiazolidinone, 3-(phenylmethyl)-2-thioxo-, 3-Benzyl-2-thioxo-1,3-thiazolan-4-one, NSC 142477, BRN 0155718, MLS002920556, 3-(Phenylmethyl)-2-thioxo-4-thiazolidinone, ZFHVUMCTGGAWBM-UHFFFAOYSA-N, 3-benzyl-2-sulfanylidene-1,3-thiazolidin-4-one, 3-Benzyl-2-thioxo-4-thiazolidinone, 3-Benzyl-2-thioxo-thiazolidin-4-one, 4-Thiazolidinone,3-(phenylmethyl)-2-thioxo-, Benzyl Rhodanine, NSC142477, benzylthioxothiazolanone, Maybridge3_004257, 3-(Phenylmethyl)rhodanide, ACMC-2098hj, C10H9NOS2, AC1L3Z00, CHEMBL224367, SCHEMBL1520611, CTK4A4093, DTXSID60147309, JS-129C, HMS1443B11, ALBB-025043, ZINC1041008, ZX-AN023557, ZX-AT009778, 8248AC, ANW-15269, BBL003962, MFCD00086924, SBB076229, STK060537, 3-benzyl-2-thioxo-thiazolidine-4-one, AKOS000313296, CCG-247263, FCH1317159, MCULE-5532081304, NSC-142477, OR14444, RP12922, IDI1_015644, KS-000017F2, BAS 00457025, SMR001798145, ZB015718, AB0156058, LS-143526, TR-001185, BB 0217732, FT-0681125, R2028, ST45022138, 3-Benzyl-2-thioxo-1,3-thiazolidin-4-one #, C-55592, I09-2434, J-511754, 4-Thiazolidinone, 3-(phenylmethyl)-2-thioxo- (9CI), C10-H9-N-O-S2, CID97673, B1656, 4-27-00-03192 (Beilstein Handbook Reference),

Complexity	249
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.013g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	223.308g/mol
Monoisotopic Mass	223.013g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P264-P280-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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