Basic information
- CAS
35947-11-6- Standard SMILES
Cc1ccc(N2CCNCC2C)cc1- InChIKey
DECNYCSJSYBABP-UHFFFAOYSA-N- Molecular formula
- C12H18N2
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.14699858
Names & identifiers
- Preferred name
- 2-Methyl-1-(p-tolyl)piperazine
- IUPAC
- 2-methyl-1-(4-methylphenyl)piperazine
- English name
- 1-(4-Methylphenyl)-2-methylpiperazine, 1:1 mixture of conformers, 97
- Molecular formula
- C12H18N2
- Molecular weight
- 190.28
Names & synonyms
2-methyl-1-(4-methylphenyl)piperazine2-Methyl-1-(p-tolyl)piperazineEINECS 252-811-6DTXSID501285634NSC 97028RefChem:474873DTXCID801716315252-811-635947-11-6MLS0027033621-(4-Methylphenyl)-2-methylpiperazineNSC97028
Show more names
2-METHYL-1-PARA-TOLYLPIPERAZINEPiperazine, 2-methyl-1-(4-methylphenyl)-1-(4-Methylphenyl)-2-methylpiperazine,97%1-(4-methylphenyl)-2-methylpiperazine, mixture of conformers1-(4-Methylphenyl)-2-methylpiperazine, 1:1 mixture of conformers, 971-(4-Methylphenyl)-2-methylpiperazine, 1:1 mixture of conformers, 97%
SCHEMBL1899257SCHEMBL4025392CHEMBL1881924MFCD00066900NSC-97028AKOS003655787SMR001570084NS00059010
Database identifiers
- CAS
35947-11-6- PubChem CID
- 98290
- DTXSID
DTXSID501285634- ChEMBL
CHEMBL1881924- EC Number
- 252-811-6
- Nikkaji
- J319.592I
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 173
Physicochemical properties
- Boiling point
- 315.8 °C · 315.8°C (rough estimate)
- Density
- 1.032 · 1.0320 (rough estimate)
- refractive index
- 1.559 · 1.5590 (estimate)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-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
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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
2 records
Compound notes
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