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2-(1-Trityl-1H-imidazol-4-yl)-ethylamine

HCID 618340
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Basic information

CAS
195053-92-0
Standard SMILES
NCCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1
InChIKey
WZPAUNPMGPHBHT-UHFFFAOYSA-N
Molecular formula
C24H23N3
Average molar mass
353.5 g/mol
Monoisotopic mass
353.18919775

Names & identifiers

Preferred name
2-(1-Trityl-1H-imidazol-4-yl)-ethylamine
IUPAC
2-(1-tritylimidazol-4-yl)ethanamine
English name
2-(1-Trityl-1H-imidazol-4-yl)-ethylamine hydrate
Molecular formula
C24H23N3
Molecular weight
353.46

Names & synonyms

195053-92-02-(1-trityl-1H-imidazol-4-yl)ethanamine2-(1-Trityl-1H-imidazol-4-yl)-ethylamine2-(1-tritylimidazol-4-yl)ethanamineMFCD067389864-(2-Aminoethyl)-1-tritylimidazole2-(1-trityl-1h-imidazol-4-yl)-ethyl amine2-[1-(triphenylmethyl)-1H-imidazol-4-yl]ethan-1-amine2-(1-TRITYL-1H-IMIDAZOL-4-YL)-ETHYLAMINE HYDRATE1-Tritylhistamine1H-IMIDAZOLE-4-ETHANAMINE, 1-(TRIPHENYLMETHYL)-N(^tau)-tritylhistamine
Show more names
N'-(3,4-dichlorophenyl)propane-1,5-diamine2-(1-trityl-1H-imidazol-4-yl)ethan-1-amine2-(1-tribenzyl-1H-imidazole-4-yl)ethylamine1-(Triphenylmethyl)-1H-Imidazole-4-ethanamine2-(1-Trityl-1H-iMidazol-4-yl)ethanaMine hydrate
SCHEMBL2035093DTXSID40347148VHA05392AKOS005067669AB28320CS-W006417DS-7768SY046442

Database identifiers

CAS
195053-92-0
PubChem CID
618340
DTXSID
DTXSID40347148
EC Number
675-812-7

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
43.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
27
Formal charge
0
Complexity
387

Physicochemical properties

storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
Appearance
Off-white to light yellow Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H315-H335
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
RIDADR
3259 · 3259
HazardClass
8 · 8
PackingGroup
Ⅲ

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

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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

Hazard Classes and CategoriesAcute Tox. 4 (50%)

Safety data

ridadr
3259
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
8
packing_group
Ⅲ
Hazard statements
H319-H315-H335
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Upstream & downstream products

Upstream raw materials

1H-?Isoindole-?1,?3(2H)?-?dione, 2-?[2-?[1-?(triphenylmethyl)?-?1H-?imidazol-?4-?yl]?ethyl]?-Acetamide, 2,2,2-trifluoro-N-[2-[1-(triphenylmethyl)-1H-imidazol-4-yl]ethyl]-TetrahydrofuranSodium hydroxideWaterMethanol

Suppliers

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Related reactions

8 records
New reaction record
HRID 240296 reaction equation
HRID 240296As productuspto-grants-2014_02
HRID 412168 reaction equation
HRID 412168As productuspto-grants-2003_05
HRID 412171 reaction equation
HRID 412171As reactantuspto-grants-2003_05
HRID 1422309 reaction equation
HRID 1422309As reactantuspto-grants-2000_06
HRID 1775029 reaction equation
HRID 1775029As reactantuspto-grants-2016_02
HRID 1775030 reaction equation
HRID 1775030As reactantuspto-grants-2016_02
HRID 2148191 reaction equation
HRID 2148191As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2408302 reaction equation
HRID 2408302As productuspto-grants-2014_08

Compound notes

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