4-Amino-6-methyl-2,3-dihydropyridazin-3-one
Basic information
- CAS
13925-21-8- Standard SMILES
Cc1cc(N)c(=O)[nH]n1- InChIKey
CHXJEGAWOLOLIO-UHFFFAOYSA-N- Molecular formula
- C5H7N3O
- Average molar mass
- 125.13 g/mol
- Monoisotopic mass
- 125.05891186
Names & identifiers
- Preferred name
- 4-Amino-6-methyl-2,3-dihydropyridazin-3-one
- IUPAC
- 5-amino-3-methyl-1H-pyridazin-6-one
- English name
- 4-Amino-6-methyl-2H-pyridazin-3-one
- Molecular formula
- C5H7N3O
- Molecular weight
- 125.13
Names & synonyms
4-amino-6-methyl-2,3-dihydropyridazin-3-oneRefChem:518013688-661-713925-21-84-Amino-6-methyl-2H-pyridazin-3-one4-amino-6-methylpyridazin-3(2H)-one5-amino-3-methyl-1H-pyridazin-6-oneMFCD001839344-amino-6-methyl-3(2H)-pyridazinoneSCHEMBL133513204-amino-6-methylpyridazin-3-olDTXSID50357430
Show more names
3(2H)-Pyridazinone, 4-amino-6-methyl-4-Amino-2,3-dihydro-6-methyl-3-oxopyridazine
4-amino-6-methyl-2-hydropyridazin-3-oneAMY34927BBL00526NAA92521BBL005268SBB079752STK636167STK724074
Database identifiers
- CAS
13925-21-8- PubChem CID
- 853445
- DTXSID
DTXSID50357430- EC Number
- 688-661-7
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- Melting point
- 268 °C · 268 °C
- Density
- 1.44 · 1.44±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 10.9 · 10.90±0.60(Predicted)
- form
- powder
- color
- Faint cream/beige
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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