Basic information
- CAS
19328-56-4- Standard SMILES
N.O=C(O)c1cccc([N+](=O)[O-])c1- InChIKey
RDWQYBUSPWIBRI-UHFFFAOYSA-N- Molecular formula
- C7H8N2O4
- Average molar mass
- 184.15 g/mol
- Monoisotopic mass
- 184.04840674
Names & identifiers
- Preferred name
- Ammonium 3-nitrobenzoate
- IUPAC
- azane;3-nitrobenzoic acid
- English name
- ammonium 3-nitrobenzoate
- Molecular formula
- C7H8N2O4
- Molecular weight
- 184.14942
Names & synonyms
Ammonium 3-nitrobenzoate19328-56-4EINECS 242-965-2DTXSID50172928RefChem:557639DTXCID0095419242-965-2Benzoic acid, 3-nitro-, ammonium salt (1:1)azane;3-nitrobenzoic acidSCHEMBL1734091RDWQYBUSPWIBRI-UHFFFAOYSA-N3-Nitrobenzoic acid--ammonia (1/1)
Show more names
3-nitrobenzoic acid, ammonium salt
Database identifiers
- CAS
19328-56-4- PubChem CID
- 88010
- DTXSID
DTXSID50172928- EC Number
- 242-965-2
Properties
Computed structural properties
- Topological polar surface area
- 84.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 198
Physicochemical properties
- Density
- 1.459 · 1.459-1.474g/cm3 at 20℃
- vapor pressure
- 0 · 0-0Pa at 25℃
- form
- Solid:particulate/powder
- LogP
- -1.52 · -1.52
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- REACH Registrations
- Active
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
Danger
H228 (66.7%): Flammable solid [Danger Flammable solids]
P210, P240, P241, 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, P370+P378, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: Ammonium 3-nitrobenzoate (EC: 242-965-2)
Hazard Classes and CategoriesFlam. Sol. 1 (66.7%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319
- REACH Registrations
- Active
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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