3H-Pyrazol-3-imine, 2,4-dihydro-5-methyl-2-phenyl-
Basic information
- CAS
6401-97-4- Standard SMILES
CC1=NN(c2ccccc2)C(=N)C1- InChIKey
VOQQGERWJRIHIK-UHFFFAOYSA-N- Molecular formula
- C10H11N3
- Average molar mass
- 173.21 g/mol
- Monoisotopic mass
- 173.09529736
Names & identifiers
- Preferred name
- 3H-Pyrazol-3-imine, 2,4-dihydro-5-methyl-2-phenyl-
- IUPAC
- 5-methyl-2-phenyl-4H-pyrazol-3-imine
- English name
- 2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-imine
- Molecular formula
- C10H11N3
- Molecular weight
- 173.21
Names & synonyms
EINECS 229-014-73H-Pyrazol-3-imine, 2,4-dihydro-5-methyl-2-phenyl-2,4-Dihydro-5-methyl-2-phenyl-3H-pyrazol-3-imineDTXSID8064309EC 229-014-7RefChem:95818DTXCID8044175229-014-76401-97-4SCHEMBL9466149SCHEMBL95125655-METHYL-2-PHENYL-2,4-DIHYDRO-3H-PYRAZOL-3-IMINE
Show more names
5-Imino-3-methyl-1-phenylpyrazole1-Phenyl – 3 Methly – 5 Imino pyrazole3-Methyl-5-imino-1-phenyl-2-pyrazoline
VOQQGERWJRIHIK-UHFFFAOYSA-NNS00008639
Database identifiers
- CAS
6401-97-4- PubChem CID
- 80812
- DTXSID
DTXSID8064309- EC Number
- 229-014-7
- Nikkaji
- J26.559D
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 39.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- EPA Substance Registry System
- 3 H-Pyrazol-3-imine, · 3H-Pyrazol-3-imine, 2,4-dihydro-5-methyl-2-phenyl- (6401-97-4)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Warning
- Hazard statements
- 302 · H302-H412-H315-H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P273-P501-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
- 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
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Danger
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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: 2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-imine (EC: 229-014-7)
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H302-H412-H315-H318
- REACH Registrations
- Active
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P273-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3H-Pyrazol-3-imine, 2,4-dihydro-5-methyl-2-phenyl-: INACTIVE
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…