Basic information
- CAS
62084-02-0- Standard SMILES
O=C(O)C1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1- InChIKey
VIISNFKYOKHEAI-UHFFFAOYSA-N- Molecular formula
- C10H7N3O5
- Average molar mass
- 249.18 g/mol
- Monoisotopic mass
- 249.03857033
Names & identifiers
- Preferred name
- 4,5-Dihydro-1-(4-nitrophenyl)-5-oxo-1H-pyrazole-3-carboxylic acid
- IUPAC
- 1-(4-nitrophenyl)-5-oxo-4H-pyrazole-3-carboxylic acid
- English name
- 4,5-dihydro-1-(4-nitrophenyl)-5-oxo-1H-pyrazole-3-carboxylic acid
- Molecular formula
- C10H7N3O5
- Molecular weight
- 249.18
Names & synonyms
62084-02-01-(4-nitrophenyl)-5-oxo-4,5-dihydro-1h-pyrazole-3-carboxylic acid4,5-Dihydro-1-(4-nitrophenyl)-5-oxo-1H-pyrazole-3-carboxylic acidG5F6FVV8L4EINECS 263-399-2NSC-132460DTXSID30211127NSC 1324601-(4-NITROPHENYL)-3-CARBOXY-5-PYRAZOLONE1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-1-(4-nitrophenyl)-5-oxo-RefChem:96471DTXCID30133618
Show more names
263-399-21-(4-nitrophenyl)-5-oxo-4H-pyrazole-3-carboxylic acidNSC132460UNII-G5F6FVV8L4VIISNFKYOKHEAI-UHFFFAOYSA-NMCA08402AKOS010648448DB-367130
Database identifiers
- CAS
62084-02-0- PubChem CID
- 97559
- DTXSID
DTXSID30211127- UNII
- G5F6FVV8L4
- EC Number
- 263-399-2
- Nikkaji
- J306.978H
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 420
Physicochemical properties
- FDA UNII
- 5 F6FVV8L4 · G5F6FVV8L4
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
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
- H319-H315-H335-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers2 total
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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