Basic information
- Standard SMILES
Cl.O=[N+]([O-])c1cccc(N2CCNCC2)c1- InChIKey
VFTSNUZGFRTULB-UHFFFAOYSA-N- Molecular formula
- C10H14ClN3O2
- Average molar mass
- 243.69 g/mol
- Monoisotopic mass
- 243.0774544
Names & identifiers
- Preferred name
- 1-(3-nitrophenyl)piperazine Hydrochloride
- IUPAC
- 1-(3-nitrophenyl)piperazine;hydrochloride
- English name
- 1-(3-NITROPHENYL)-PIPERAZINE
- Molecular formula
- C10H14ClN3O2
- Molecular weight
- 243.69
Names & synonyms
Show more names
Database identifiers
- CAS
294210-79-0- PubChem CID
- 2760215
- DTXSID
DTXSID10375059- EC Number
- 673-894-9
Properties
Computed structural properties
- Topological polar surface area
- 61.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 223
Physicochemical properties
- Melting point
- 230 °C · >230°C
- CAS DataBase Reference
- 294210 · 294210-79-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H302-H335-H332-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H312-H302-H335-H332-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers16 total
Related reactions
Linked notes
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