Basic information
- CAS
1006327-22-5- Standard SMILES
Cc1c(-c2ccn[nH]2)cnn1C- InChIKey
PSTZZJLKXUAJAQ-UHFFFAOYSA-N- Molecular formula
- C8H10N4
- Average molar mass
- 162.19 g/mol
- Monoisotopic mass
- 162.09054634
Names & identifiers
- Preferred name
- 1',5'-dimethyl-1H,1'H-3,4'-bipyrazole
- IUPAC
- 1,5-dimethyl-4-(1H-pyrazol-5-yl)pyrazole
- English name
- 1,5-dimethyl-1H,1H-3,4-bipyrazole
- Molecular formula
- C8H10N4
- Molecular weight
- 162.19
Names & synonyms
1',5'-dimethyl-1H,1'H-3,4'-bipyrazole1006327-22-51',5'-Dimethyl-1H,1'H-[3,4']bipyrazolyl1,5-dimethyl-4-(1H-pyrazol-5-yl)pyrazoleMFCD049708581,5-dimethyl-4-(1H-pyrazol-3-yl)-1H-pyrazole1',5'-DIMETHYL-1H-3,4'-BIPYRAZOLE1,5-dimethyl-4-pyrazol-3-ylpyrazoleSCHEMBL9464832SCHEMBL21233194SCHEMBL21241222DTXSID201297113
Show more names
1,5-dimethyl-1H,1H-3,4-bipyrazole3,4'-Bi-1H-pyrazole, 1',5'-dimethyl-
GQB32722SBB022432STK349796AKOS000311229NCGC00339697-01ST103117CS-0279759ST45115284
Database identifiers
- CAS
1006327-22-5- PubChem CID
- 7147384
- DTXSID
DTXSID201297113
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- Boiling point
- 360 · 360.0±30.0 °C(Predicted)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- 12.94 · 12.94±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
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
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers3 total
Fluorochem Ltd[email protected]
PRINCETON[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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