p-Tolylguanidinium nitrate
Basic information
- CAS
79574-98-4- Standard SMILES
Cc1ccc([NH+]=C(N)N)cc1.O=[N+]([O-])[O-]- InChIKey
CXULDDXGJVXNQQ-UHFFFAOYSA-O- Molecular formula
- C8H12N4O3
- Average molar mass
- 212.21 g/mol
- Monoisotopic mass
- 212.09094026
Names & identifiers
- Preferred name
- p-Tolylguanidinium nitrate
- IUPAC
- diaminomethylidene-(4-methylphenyl)azanium nitrate
Names & synonyms
p-Tolylguanidinium nitrateEINECS 279-190-4RefChem:858249279-190-4DTXSID501000602Amino(4-methylanilino)methaniminium nitrate
Database identifiers
- CAS
79574-98-4- PubChem CID
- 23636769
- DTXSID
DTXSID501000602- EC Number
- 279-190-4
Properties
Computed structural properties
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 160
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
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Related reactions
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Compound notes
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