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4-(Imidazo(1,2-a)pyridin-2-yl)aniline

HCID 696936
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
139705-74-1
Standard SMILES
Nc1ccc(-c2cn3ccccc3n2)cc1
InChIKey
FPCHINCJTRAFAK-UHFFFAOYSA-N
Molecular formula
C13H11N3
Average molar mass
209.25 g/mol
Monoisotopic mass
209.09529736

Names & identifiers

Preferred name
4-(Imidazo(1,2-a)pyridin-2-yl)aniline
IUPAC
4-imidazo[1,2-a]pyridin-2-ylaniline
English name
4-IMIDAZO[1,2-A]PYRIDIN-2-YL-PHENYLAMINE
Molecular formula
C13H11N3
Molecular weight
209.25

Names & synonyms

139705-74-14-(imidazo[1,2-a]pyridin-2-yl)aniline4-{imidazo[1,2-a]pyridin-2-yl}anilineDTXSID003513074-(Imidazo(1,2-a)pyridin-2-yl)anilineRefChem:289115DTXCID40302373825-305-34-imidazo[1,2-a]pyridin-2-ylaniline4-Imidazo[1,2-a]pyridin-2-yl-phenylamine4-Imidazo[1,2-a]pyridin-2-ylphenylamineMFCD00107394
Show more names
IFLAB-BB F1912-00164-(Imidazo[1,2-a]pyrid-2-yl)aniline,95%2-(4-Aminophenyl)imidazo[1,2-a]pyridine4-(IMidazo[1,2-a]pyrid-2-yl)aniline, 95%4-Imidazo[1,2-a]pyridin-2-yl-benzenamine
Benzenamine, 4-imidazo[1,2-a]pyridin-2-yl-4-(4-hydroimidazo[1,2-a]pyridin-2-yl)phenylamineTimTec1_007065Oprea1_061485Oprea1_571115SCHEMBL979566F1912-0016CCG-491

Database identifiers

CAS
139705-74-1
PubChem CID
696936
DTXSID
DTXSID00351307
EC Number
825-305-3
Nikkaji
J1.118.399I

Properties

Computed structural propertiesFilling in

XLogP
2.7
Topological polar surface area
43.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
235

Physicochemical properties

Melting point
204 · 204-206°
Density
1.24 · 1.24±0.1 g/cm3(Predicted)
storage temp.
2 · 2-8°C
form
solid
pka
6.97 · 6.97±0.50(Predicted)
color
Off-white
CAS DataBase Reference
139705 · 139705-74-1
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
HazardClass
IRRITANT
HS Code
2933399990 · 2933399990

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

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Applications

Uses4-Imidazo[1,2-a]pyridin-2-ylaniline is an intermediate used in the preparation of new imidazopyridines as angiotensin antagonists with antihypertensive activity.

Related reactions

3 records
New reaction record
HRID 124730 reaction equation
HRID 124730As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 339553 reaction equation
HRID 339553As productuspto-grants-2014_11
HRID 1914810 reaction equation
HRID 1914810As productuspto-grants-2013_12

Compound notes

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