Basic information
- CAS
1606-76-4- Standard SMILES
O=[N+]([O-])c1nccs1- InChIKey
ALNUOSXDMYFQNQ-UHFFFAOYSA-N- Molecular formula
- C3H2N2O2S
- Average molar mass
- 130.13 g/mol
- Monoisotopic mass
- 129.98369848
Names & identifiers
- Preferred name
- 2-Nitrothiazole
- IUPAC
- 2-nitro-1,3-thiazole
- English name
- 2-Nitrothiazole
- Molecular formula
- C3H2N2O2S
- Molecular weight
- 130.13
Names & synonyms
2-NITROTHIAZOLE1606-76-4Thiazole, 2-nitro-DTXSID3073268RefChem:1063939DTXCID90351712-Nitro-1,3-thiazoleMFCD01760316NSC3550432-Nitro-1,3-thiazole #SCHEMBL208274SCHEMBL2044603
Show more names
SCHEMBL2045342ALNUOSXDMYFQNQ-UHFFFAOYSA-ALNUOSXDMYFQNQ-UHFFFAOYSA-NBAA60676AKOS015917406NSC 355043NSC-355043AS-85867
Database identifiers
- CAS
1606-76-4- PubChem CID
- 74153
- DTXSID
DTXSID3073268- Nikkaji
- J100.423I
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 102
Physicochemical properties
- Melting point
- 76 °C · 76 °C
- Boiling point
- 278.6 · 278.6±23.0 °C(Predicted)
- Density
- 1.549 · 1.549±0.06 g/cm3(Predicted)
- pka
- -1.83 · -1.83±0.10(Predicted)
- EPA Substance Registry System
- 2 · Thiazole, 2-nitro- (1606-76-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers15 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
无锡捷化医药科技有限公司83588313 18800520310 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
Aladdin Scientific[email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Mainchem Co., Ltd.+86-86-05926210733 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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