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((Phenylthioxomethyl)thio)acetic acid (C9H8O2S2)

((Phenylthioxomethyl)thio)acetic acid presents a C9 framework, aromatic rings, a carboxylic acid (formula C9H8O2S2, CAS 942-91-6). ChemicalTool Reaction can propose ranked disconnections for ((Phenylthioxomethyl)thio)acetic acid from the SMILES O=C(O)CSC(=S)c1ccccc1.

Target
((Phenylthioxomethyl)thio)acetic acid
CAS
942-91-6
Formula
C9H8O2S2
Approx. MW
212.28
SMILES
O=C(O)CSC(=S)c1ccccc1
PubChem CID
70336
Approx. carbons
C9

((Phenylthioxomethyl)thio)acetic acid structure

Properties

IUPAC name
2-(benzenecarbonothioylsulfanyl)acetic acid
Common names
Acetic acid, [(phenylthioxomethyl)thio]-; EINECS 213-393-0; ((Phenylthioxomethyl)thio)acetic acid; DTXSID30240972; [(phenylthioxomethyl)thio]acetic acid; Acetic acid, ((phenylthioxomethyl)thio)-; RefChem:390447; Thiobenzoylmercaptoacetic acid; DTXCID60163463; 213-393-0
Molecular weight
212.30
Exact mass
212.00
InChIKey
XBEIANFIOZTEDE-UHFFFAOYSA-N

View on PubChem

((Phenylthioxomethyl)thio)acetic acid 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of ((Phenylthioxomethyl)thio)acetic acid?

((Phenylthioxomethyl)thio)acetic acid has molecular formula C9H8O2S2. Molecular weight about 212.28 g·mol⁻¹.

What is the CAS number of ((Phenylthioxomethyl)thio)acetic acid?

The CAS Registry Number for ((Phenylthioxomethyl)thio)acetic acid is 942-91-6.

Run AI retrosynthesis for ((Phenylthioxomethyl)thio)acetic acid Target catalog AI tools overview

Open the planner with ((Phenylthioxomethyl)thio)acetic acid preloaded, then keep routes that match CAS 942-91-6.

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References & tools