Basic information
- CAS
3484-33-1- Standard SMILES
CNc1ccc([N+](=O)[O-])cc1C(=O)O- InChIKey
FAVDVRYGVZMEFI-UHFFFAOYSA-N- Molecular formula
- C8H8N2O4
- Average molar mass
- 196.16 g/mol
- Monoisotopic mass
- 196.04840674
Names & identifiers
- Preferred name
- 2-(Methylamino)-5-nitrobenzoic acid
- IUPAC
- 2-(methylamino)-5-nitrobenzoic acid
- English name
- 2-(Methylamino)-5-nitrobenzoic acid
- Molecular formula
- C8H8N2O4
- Molecular weight
- 196.16
Names & synonyms
2-(methylamino)-5-nitrobenzoic acid3484-33-1benzoic acid, 2-(methylamino)-5-nitro-DTXSID80349141RefChem:461295DTXCID40300213983-006-4InChI=1/C8H8N2O4/c1-9-7-3-2-5(10(13)14)4-6(7)8(11)12/h2-4,9H,1H3,(H,11,12MFCD00956206Benzoic acid,2-(methylamino)-5-nitro-2-(METHYLAMINO)-5-NITROBENZOICACIDOprea1_453802
Show more names
MLS000774225CHEMBL288945SCHEMBL15312972-methylamino-5-nitrobenzoic acid5-nitro-N-methyl-anthranilic acidHMS2752J05DAA48433STK368287
Database identifiers
- CAS
3484-33-1- PubChem CID
- 643299
- DTXSID
DTXSID80349141- ChEMBL
CHEMBL288945- EC Number
- 983-006-4
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 238
Experimental & physicochemical properties
Solubility26.7 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- storage temp.
- 2 · 2-8°C, protect from light
- Appearance
- Light yellow to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
- HS Code
- 2922498590 · 2922498590
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, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+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
- hs_code
- 2922498590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Suppliers11 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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