Basic information
- CAS
1147-64-4- Standard SMILES
O=C(O)c1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1- InChIKey
PAXANYFYBRBZOE-UHFFFAOYSA-N- Molecular formula
- C11H6Cl2N2O3
- Average molar mass
- 285.08 g/mol
- Monoisotopic mass
- 283.9755474
Names & identifiers
- Preferred name
- 4-(4,5-Dichloro-6-oxo-1,6-dihydropyridazin-1-yl)benzoic acid
- IUPAC
- 4-(4,5-dichloro-6-oxopyridazin-1-yl)benzoic acid
- English name
- 4-(4,5-DICHLORO-6-OXOPYRIDAZIN-1(6H)-YL)BENZOIC ACID
- Molecular formula
- C11H6Cl2N2O3
- Molecular weight
- 285.08
Names & synonyms
4-(4,5-dichloro-6-oxo-1,6-dihydropyridazin-1-yl)benzoic acid4-(4,5-dichloro-6-oxo-1(6H)-pyridazinyl)benzoic acidRefChem:513484841-272-81147-64-44-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)benzoic acid4-(4,5-dichloro-6-oxopyridazin-1-yl)benzoic acidMFCD01918613Benzoic acid, 4-(4,5-dichloro-6-oxo-1(6H)-pyridazinyl)-4-(4,5-dichloro-6-oxohydropyridazinyl)benzoic acidCBMicro_001818ChemDiv2_003127
Show more names
Oprea1_039133MLS001206316CHEMBL1888280SCHEMBL118877924-(4,5-Dichloro-6-oxo-6H-pyridazin-1-yl)-benzoic acidDTXSID803521554-(4,5-DICHLORO-6-OXOPYRIDAZIN-1(6H)-YL)BENZOICACIDHMS1377O03
Database identifiers
- CAS
1147-64-4- PubChem CID
- 720228
- DTXSID
DTXSID80352155- ChEMBL
CHEMBL1888280
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 440
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H302-H319-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H302-H319-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
赛纳斯特化学（欢迎点击联系）021-60343070
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…