HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

2,5-Dibromo-1-tritylimidazole

HCID 5000572
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
850429-53-7
Standard SMILES
Brc1cnc(Br)n1C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIKey
GGUUMQXVXRVHTE-UHFFFAOYSA-N
Molecular formula
C22H16Br2N2
Average molar mass
468.2 g/mol
Monoisotopic mass
465.96802

Names & identifiers

Preferred name
2,5-Dibromo-1-tritylimidazole
IUPAC
2,5-dibromo-1-tritylimidazole
English name
2,5-DIBROMO-1-TRITYLIMIDAZOLE
Molecular formula
C22H16Br2N2
Molecular weight
468.18

Names & synonyms

2,5-dibromo-1-tritylimidazole850429-53-7DTXSID10407400RefChem:444223DTXCID20358252689-711-02,5-Dibromo-1-trityl-1H-imidazoleMFCD041157312,5-dibromo-1-(triphenylmethyl)-1H-imidazoleAKOS015834934AB20488BS-24183
Show more names
2,5-Dibromo-1-trityl-1H-imidazole95%2,5-Dibromo-1-trityl-1H-imidazole 95%1H-Imidazole, 2,5-dibromo-1-(triphenylmethyl)-
CS-0456209

Database identifiers

CAS
850429-53-7
PubChem CID
5000572
DTXSID
DTXSID10407400
EC Number
689-711-0

Properties

Computed structural properties

XLogP
6.8
Topological polar surface area
17.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
26
Formal charge
0
Complexity
394

Physicochemical properties

Melting point
154 · 154-158
Boiling point
579.4 · 579.4±60.0 °C(Predicted)
Density
1.46 · 1.46±0.1 g/cm3(Predicted)
storage temp.
2 · Sealed in dry,2-8°C
pka
1.33 · 1.33±0.50(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H332-H312
Precautionary statements
264 · P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501
Hazard Codes
Xi
Hazard Note
Irritant/Keep Cold
HS Code
2933299090 · 2933299090

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 · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, 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.

Safety data

hs_code
2933299090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant/Keep Cold
Hazard statements
H302-H332-H312
Precautionary statements
P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes