Basic information
- CAS
827-43-0- Standard SMILES
Cc1cnc(-c2ccccc2)[nH]1- InChIKey
TYOXIFXYEIILLY-UHFFFAOYSA-N- Molecular formula
- C10H10N2
- Average molar mass
- 158.2 g/mol
- Monoisotopic mass
- 158.08439833
Names & identifiers
- Preferred name
- 4-Methyl-2-phenyl-1H-imidazole
- IUPAC
- 5-methyl-2-phenyl-1H-imidazole
- English name
- 4-Methyl-2-phenyl-1H-imidazole
- Molecular formula
- C10H10N2
- Molecular weight
- 158.2
Names & synonyms
4-Methyl-2-phenyl-1H-imidazole827-43-01H-Imidazole, 4-methyl-2-phenyl-2-Phenyl-4-methylimidazole1H-Imidazole, 5-methyl-2-phenyl-DTXSID8061187EINECS 212-571-5RefChem:525147DTXCID8048317212-571-54-Methyl-2-phenylimidazole5-methyl-2-phenyl-1H-imidazole
Show more names
4-Methyl-4-methylimidazole4-Mehtyl-2-phenylimidazole2. Morgan-4-methylimidazole4-methyl-2-phenyl-1h-imidazol2-Phenyl-5-methyl-1H-imidazole2-Phenyl-4-methyl-1H-imidazole
MFCD00047015methyl-2-phenylimidazole5-methyl-2-phenylimidazoleSCHEMBL496124-Methyl-2-phenylimidazole, 95%STK192082AKOS003656985AKOS025394854
Database identifiers
- CAS
827-43-0- PubChem CID
- 70012
- DTXSID
DTXSID8061187- EC Number
- 212-571-5
- Nikkaji
- J139.694C
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 141
Physicochemical properties
- Melting point
- 180 · 180-183 °C (lit.)
- Boiling point
- 352.7 · 352.7±11.0 °C(Predicted)
- Density
- 1.109 · 1.109±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Water Solubility
- Insoluble in water
- form
- powder to crystal
- pka
- 13.22 · 13.22±0.10(Predicted)
- color
- White to Light yellow
- BRN
- 4112 · 4112
- InChI
- InChI=1S/C10H10N2/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,11,12)
- InChIKey
- TYOXIFXYEIILLY-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=CC=C2)NC(C)=CN=1
- CAS DataBase Reference
- 827 · 827-43-0(CAS DataBase Reference)
- EPA Substance Registry System
- 1 H-Imidazole, · 1H-Imidazole, 4-methyl-2-phenyl- (827-43-0)
- UNSPSC Code
- 12352100 · 12352100
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 83 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 1H-Imidazole, 4-methyl-2-phenyl-
1H-Imidazole, 4-methyl-2-phenyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29332900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Imidazole, 5-methyl-2-phenyl-: ACTIVE
Applications
Uses4-Methyl-2-phenylimidazole is suitable for use to investgate the cytotoxic activity of 4-trifluoromethylimidazoles against human tumor and normal cells. It may be used in following studies:Curing of epoxy system consisting of a diglycidyl ether of bisphenol-F epoxy resin, 1,4-butanediol. Curing of bisphenol-F epoxy resin. Synthesis of aza-heterocyclic compounds.Preparation of 1-[(2-chlorophenyl)(diphenyl)methyl]-4-methyl-2-phenyl-1H-imidazole.
General Description4-Methyl-2-phenylimidazole is a 4-substituted-2-phenylimidazole. It participates in ring-opening of various bicyclic olefins to afford trans-3,4-disubstituted derivatives. The FT-IR, FT-Raman and FT-NMR spectra of 4-methyl-2-phenylimidazole has been recorded.
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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