4-(4,5-Dihydro-1H-imidazol-2-yl)phenylamine
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Basic information
- CAS
61033-71-4- Standard SMILES
Nc1ccc(C2=NCCN2)cc1- InChIKey
HSJPRHDSBNINIJ-UHFFFAOYSA-N- Molecular formula
- C9H11N3
- Average molar mass
- 161.2 g/mol
- Monoisotopic mass
- 161.09529736
Names & identifiers
- Preferred name
- 4-(4,5-Dihydro-1H-imidazol-2-yl)phenylamine
- IUPAC
- 4-(4,5-dihydro-1H-imidazol-2-yl)aniline
- English name
- BenzenaMine, 4-(4,5-dihydro-1H-iMidazol-2-yl)-
- Molecular formula
- C9H11N3
- Molecular weight
- 161.2
Names & synonyms
4-(4,5-Dihydro-1H-imidazol-2-yl)phenylamineRefChem:513489690-581-24-(4,5-dihydro-1H-imidazol-2-yl)aniline61033-71-4Benzenamine, 4-(4,5-dihydro-1H-imidazol-2-yl)-MFCD000335382-(p-Aminophenyl)-2-imidazolineSCHEMBL1685409DTXSID40326271HSJPRHDSBNINIJ-UHFFFAOYSA-N2-(4-aminophenyl)-1H-imidazoline
Show more names
4-(4,5-Dihydro-1HH-imidazol-2-yl)phenylamine
2-Imidazoline, 2-(p-aminophenyl)-AKOS005444849SY081580F756374-(4,5-Dihydro-1H-imidazol-2-yl)-phenylamineF0997604-(4,5-Dihydro-1H-imidazol-2-yl)phenylamine, 97%
Database identifiers
- CAS
61033-71-4- PubChem CID
- 352372
- DTXSID
DTXSID40326271- EC Number
- 690-581-2
- Nikkaji
- J3.238.972D
Properties
Computed structural propertiesFilling in
- XLogP
- 0.2
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Melting point
- 145 · 145-149 °C
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- powder
- color
- Ivory
- InChI
- 1S/C9H11N3/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4H,5-6,10H2,(H,11,12)
- InChIKey
- HSJPRHDSBNINIJ-UHFFFAOYSA-N
- SMILES
- Nc1ccc(cc1)C2=NCCN2
- UNSPSC Code
- 12352100 · 12352100
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
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 40 reports by companies from 3 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
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- WGK 3
- hs_code
- 2933299090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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