5-(3-Methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid
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5-(3-Methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid
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CAS No:
41504-19-2
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Formula:
C13H10N2O3S3
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Chemical Name:
5-(3-Methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid
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Synonyms:
3-Thiazolidineacetic acid,5-(3-methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-;5-(3-Methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid;5-(3-Methyl-2-benzothiazolinylidene)-3-carboxymethylrhodanine;[5-(3-Methyl-3H-benzothiazol-2-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-acetic acid
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CAS No:
5-(3-Methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid Basic Attributes
338.4 g/mol
338.43
255-416-7
DTXSID4068321
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-(3-Methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid Use and Manufacturing
3-Thiazolidineacetic acid, 5-(3-methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thioxo-: ACTIVE
Computed Properties
Molecular Weight:338.4
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:337.98535571
Monoisotopic Mass:337.98535571
Topological Polar Surface Area:144
Heavy Atom Count:21
Complexity:549
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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