Basic information
- CAS
17629-26-4- Standard SMILES
CCn1nc(C)cc1C- InChIKey
WBTANXHOAUWNIK-UHFFFAOYSA-N- Molecular formula
- C7H12N2
- Average molar mass
- 124.18 g/mol
- Monoisotopic mass
- 124.10004839
Names & identifiers
- Preferred name
- 1-Ethyl-3,5-dimethyl-1H-pyrazole
- IUPAC
- 1-ethyl-3,5-dimethylpyrazole
- English name
- 1-Ethyl-3,5-dimethyl-1H-pyrazole
- Molecular formula
- C7H12N2
- Molecular weight
- 124.18
Names & synonyms
1-Ethyl-3,5-dimethyl-1H-pyrazole17629-26-4DTXSID50340600RefChem:1055424DTXCID302916811-ethyl-3,5-dimethylpyrazole1H-Pyrazole, 1-ethyl-3,5-dimethyl-MFCD026018341-ethyl-3,5-dimethyl-pyrazolePyrazole, 1-ethyl-3,5-dimethyl-SCHEMBL324398SCHEMBL324399
Show more names
AKOS PAO-1134VITAS-BB TBB0006561-ethyl-3,5-dimethyl-1H-pyrazole(SALTDATA: FREE)
SCHEMBL2020934SCHEMBL2020938SCHEMBL3337771WBTANXHOAUWNIK-UHFFFAOYSA-NALBB-0044523,5-Dimethyl-1-ethyl-1H-pyrazoleSBB024588STK346768
Database identifiers
- CAS
17629-26-4- PubChem CID
- 565993
- DTXSID
DTXSID50340600- Nikkaji
- J100.516B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 92.9
Physicochemical properties
- Boiling point
- 172 · 172-173 °C
- Density
- 0.9342 g/cm3 · 0.9342 g/cm3(Temp: 16.7 °C)
- storage temp.
- 2 · 2-8°C
- pka
- 3.32 · 3.32±0.10(Predicted)
- HazardClass
- IRRITANT
- HS Code
- 2933199090 · 2933199090
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
- 2933199090
- hazard_class
- IRRITANT
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers26 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
北京亿思研科技开发中心010-56645598 13366904824 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
杭州莱晟生物科技有限公司13456210265 · [email protected]
谱尼生物医药科技（上海）有限公司021-021-64851999-6515-6515 13817808647 · [email protected]
武汉开诺医药科技有限公司18040571231/1402788087
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
Henan Alfa Chemical Co., Ltd
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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