Basic information
- CAS
107190-42-1- Standard SMILES
O=[N+]([O-])c1sc(Cl)nc1Cl- InChIKey
UNWUPQUTAGSGOA-UHFFFAOYSA-N- Molecular formula
- C3Cl2N2O2S
- Average molar mass
- 199.01 g/mol
- Monoisotopic mass
- 197.9057536
Names & identifiers
- Preferred name
- 2,4-Dichloro-5-nitro-1,3-thiazole
- IUPAC
- 2,4-dichloro-5-nitro-1,3-thiazole
- English name
- 2,4-Dichloro-5-nitrothiazole
- Molecular formula
- C3Cl2N2O2S
- Molecular weight
- 199.02
Names & synonyms
2,4-dichloro-5-nitro-1,3-thiazole107190-42-1DTXSID40551223RefChem:246248DTXCID30502007961-437-92,4-Dichloro-5-nitrothiazoleC3Cl2N2O2SMFCD111312372,4-dichloro-5-nitro-thiazoleThiazole, 2,4-dichloro-5-nitro-SCHEMBL6509690
Show more names
UNWUPQUTAGSGOA-UHFFFAOYSA-NHEA19042SBB092406AKOS000211920FD-0215DA-27300CS-0450032EN300-73380
Database identifiers
- CAS
107190-42-1- PubChem CID
- 13851817
- DTXSID
DTXSID40551223- EC Number
- 961-437-9
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 152
Physicochemical properties
- Boiling point
- 340.6 · 340.6±45.0 °C(Predicted)
- Density
- 1.844 · 1.844±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -5.61 · -5.61±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- HS Code
- 2934100090 · 2934100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2934100090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Suppliers8 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
Changzhou Exploring Chemical Co., Ltd15295164949 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
25 records
Compound notes
Loading…