Basic information
- CAS
73870-33-4- Standard SMILES
O=NN1CCSC1- InChIKey
PROHBUGJUQHONA-UHFFFAOYSA-N- Molecular formula
- C3H6N2OS
- Average molar mass
- 118.16 g/mol
- Monoisotopic mass
- 118.02008399
Overview
N-nitroso-1,3-thiazolidine is a member of thiazolidines and a nitrosamine.
Names & identifiers
- Preferred name
- 3-Nitrosothiazolidine
- IUPAC
- 3-nitroso-1,3-thiazolidine
- English name
- N-nitrosothiazolidine
- Molecular formula
- C3H6N2OS
- Molecular weight
- 118.16
Names & synonyms
N-Nitrosothiazolidine3-Nitrosothiazolidine73870-33-4DTXSID70224458RefChem:164035DTXCID701469493-Nitroso-1,3-thiazolidineTHIAZOLIDINE, 3-NITROSO-CCRIS 5493N-Nitroso-1,3-thiazolidineThiazolidine,3-nitroso-3-Nitrosothiazolidine;Thiazolidine, 3-nitroso- (9CI, ACI); 3-Nitrosothiazolidine (ACI); 3-Nitroso-1,3-thiazolidine; N-Nitrosothiazolidine
Show more names
RMA-729NITROSOTHIAZOLIDINEThiazolidine Impurity 13 (N-Nitroso Thiazolidine)
N-Nitrosothiazolidin3-nitroso-ThiazolidineCHEBI:7329Q753P5BBM73-Nitroso-1,3-thiazolidine #SCHEMBL29091939PROHBUGJUQHONA-UHFFFAOYSA-NAKOS006272878
Database identifiers
- CAS
73870-33-4- PubChem CID
- 52687
- DTXSID
DTXSID70224458- ChEBI
CHEBI:7329- UNII
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 77.3
Physicochemical properties
- Boiling point
- 299.9 · 299.9±33.0 °C(Predicted)
- Density
- 1.24 · 1.240 (estimate)
- refractive index
- 1.7 · 1.7000 (estimate)
- pka
- -6.14 · -6.14±0.20(Predicted)
- Toxicity
- 50 orl-rat: · LD50 orl-rat: 1950 mg/kg JTEHD6 13,595,84
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 orl-rat: 1950 mg/kg JTEHD6 13,595,84
Chemistry & industry
Applications
Uses3-Nitrosothiazolidine is a nitrosamine present in food products, a carcinogenic substance.
Suppliers9 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
山东博洛达生物科技有限公司0531-68651502 · [email protected]
南京博济达医药科技有限公司18762407961 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
Additional notes
DefinitionChEBI: N-nitroso-1,3-thiazolidine is a nitrosamine and a member of thiazolidines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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