3-tert-butyl-1H-pyrazole-5-carbohydrazide
Basic information
- CAS
262292-02-4- Standard SMILES
CC(C)(C)c1cc(C(=O)NN)n[nH]1- InChIKey
ZJFRMJHBYDBUGG-UHFFFAOYSA-N- Molecular formula
- C8H14N4O
- Average molar mass
- 182.22 g/mol
- Monoisotopic mass
- 182.11676108
Names & identifiers
- Preferred name
- 3-tert-butyl-1H-pyrazole-5-carbohydrazide
- IUPAC
- 5-tert-butyl-1H-pyrazole-3-carbohydrazide
- English name
- 3-(tert-Butyl)-1H-pyrazole-5-carbohydrazide
- Molecular formula
- C8H14N4O
- Molecular weight
- 182.22
Names & synonyms
262292-02-43-tert-butyl-1H-pyrazole-5-carbohydrazideDTXSID90352101RefChem:282660DTXCID803031673-(tert-Butyl)-1H-pyrazole-5-carbohydrazide5-tert-butyl-1H-pyrazole-3-carbohydrazideMFCD006193181H-Pyrazole-3-carboxylic acid, 5-(1,1-dimethylethyl)-, hydrazide5-(tert-Butyl)-1H-pyrazole-3-carbohydrazide3-(Tert-butyl)-1h-pyrazole-5-C5-(1,1-dimethylethyl)-1H-Pyrazole-3-carboxylic acid hydrazide
Show more names
AKOS BBS-000045273-Tert-butyl-1H-pyrazole-5-carbohydrazide ,97%5-TERT-BUTYL-2H-PYRAZOLE-3-CARBOXYLIC ACID HYDRAZIDE
3-(tert-butyl)pyrazole-5-carbohydrazide3-(tert-Butyl)-1H-pyrazole-5-carboxylic acid hydrazideMaybridge1_008395Cambridge id 5574572Oprea1_503907SCHEMBL1815054HMS565F13BUTTPARK 96\06-59
Database identifiers
- CAS
262292-02-4- PubChem CID
- 718956
- DTXSID
DTXSID90352101
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Melting point
- 177 °C · 177 °C
- Density
- 1.174 · 1.174±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 11.94 · 11.94±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 260 · P260-P280-P312
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HazardClass
- IRRITANT
- HS Code
- 29331990 · 29331990
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
- 29331990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P260-P280-P312
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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