Basic information
- CAS
810-16-2- Standard SMILES
Cc1c(N(C)CN(C)c2c(C)n(C)n(-c3ccccc3)c2=O)c(=O)n(-c2ccccc2)n1C- InChIKey
GEFDLFMKEPTYLA-UHFFFAOYSA-N- Molecular formula
- C25H30N6O2
- Average molar mass
- 446.5 g/mol
- Monoisotopic mass
- 446.24302422
Names & identifiers
- Preferred name
- 4,4'-[methylenebis(methylimino)]bis[1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one]
- IUPAC
- 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylamino]methyl-methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one
- English name
- 4,4'-[methylenebis(methylimino)]bis[1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one]
- Molecular formula
- C25H30N6O2
- Molecular weight
- 446.5447
Names & synonyms
810-16-2EINECS 212-369-74,4'-[METHYLENEBIS(METHYLIMINO)]BIS[1,2-DIHYDRO-1,5-DIMETHYL-2-PHENYL-3H-PYRAZOL-3-ONE]NSC 1267614,4'-(Methylenebis(methylimino))bis(1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one)DTXSID60230846RefChem:96198DTXCID90153337212-369-74,4'-[Methylenebis(methylimino)]diantipyrineMetamizole Impurity 5NSC126761
Show more names
Brivudine Impurity 47methylene bismethylaminoantipyreneMETHYLENE BISMETHYLAMINOANTIPYRINE4,4'-Methylenbis-(methylimino)-bis-(1,2-dihydro-1,5-dimethyl-2-phenyl)-3H-pyrazol-3-on
4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylamino]methyl-methylamino]-1,5-dimethyl-2-phenylpyrazol-3-oneGEFDLFMKEPTYLA-UHFFFAOYSA-NAKOS024430037NSC-126761NS00038102N,N'-METHYLENEBIS(4-(METHYLAMINO)ANTIPYRINE)4,4'-[Methylenebis(methylazanediyl)]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)Bis[N-methyl(antipyrinyl)amino]methane; 4,4'-[Methylenebis(methylimino)]bis[1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one]
Database identifiers
- CAS
810-16-2- PubChem CID
- 69935
- DTXSID
DTXSID60230846- EC Number
- 212-369-7
- Nikkaji
- J61.559E
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 53.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 772
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
Uses4,4''-[Methylenebis(methylimino)]diantipyrine is a derivative of 4-Dimethylamino Antipyrine(D460890) which is an antipyretic; analgesic.
Suppliers3 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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