Basic information
- CAS
19933-25-6- Standard SMILES
c1cc(-c2ccsc2)[nH]n1- InChIKey
UOAGMESLUAMTIP-UHFFFAOYSA-N- Molecular formula
- C7H6N2S
- Average molar mass
- 150.2 g/mol
- Monoisotopic mass
- 150.02516937
Names & identifiers
- Preferred name
- 5-(3-Thienyl)-1h-pyrazole
- IUPAC
- 5-thiophen-3-yl-1H-pyrazole
- English name
- 3-(3-thienyl)-1H-pyrazole(SALTDATA: 0.7H2O)
- Molecular formula
- C7H6N2S
- Molecular weight
- 150.2
Names & synonyms
19933-25-65-(3-thienyl)-1h-pyrazoleDTXSID60352577RefChem:299743DTXCID803036425-(thiophen-3-yl)-1H-pyrazole5-thiophen-3-yl-1H-pyrazole3-(3-thienyl)-1H-Pyrazole3-(thiophen-3-yl)-1H-pyrazole1H-Pyrazole, 3-(3-thienyl)-MFCD001210145-thien-3-yl-1H-pyrazole
Show more names
3-(3-thienyl)-1H-pyrazole(SALTDATA: 0.7H2O)3-pyrazol-5-ylthiopheneMaybridge3_001322orb3026150SCHEMBL3449914SCHEMBL5466824SCHEMBL9465257SCHEMBL13735370
Database identifiers
- CAS
19933-25-6- PubChem CID
- 729699
- DTXSID
DTXSID60352577- Nikkaji
- J2.326.823J
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 56.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Physicochemical properties
- Melting point
- 111 · 111-113 °C
- Boiling point
- 306.5 · 306.5±17.0 °C(Predicted)
- Density
- 1.297 · 1.297±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.76 · 13.76±0.10(Predicted)
- HS Code
- 2933119000 · 2933119000
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
- hs_code
- 2933119000
Chemistry & industry
Suppliers9 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
成都效佳科技有限公司15902830537 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
陕西伊坤特医药科技有限公司18049260030 18049260030 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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