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Pyridine-2-azo-p-dimethylaniline

HCID 81528
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Basic information

CAS
13103-75-8
Standard SMILES
CN(C)c1ccc(N=Nc2ccccn2)cc1
InChIKey
IOJNPSPGHUEJAQ-UHFFFAOYSA-N
Molecular formula
C13H14N4
Average molar mass
226.28 g/mol
Monoisotopic mass
226.12184646

Overview

structure in first source

Names & identifiers

Preferred name
Pyridine-2-azo-p-dimethylaniline
IUPAC
N,N-dimethyl-4-(pyridin-2-yldiazenyl)aniline
English name
4-(2-Pyridylazo)-N,N-dimethylaniline
Molecular formula
C13H14N4
Molecular weight
226.28

Names & synonyms

13103-75-8Pyridine-2-azo-p-dimethylanilineDTXSID001302586RefChem:822467DTXCID8013332484-(2-Pyridylazo)-N,N-dimethylanilinePADAN,N-dimethyl-4-(pyridin-2-yldiazenyl)anilineN,N-Dimethyl-4-(2-pyridylazo)anilinePyridine-2-azodimethylanilinep-(2-Pyridylazo)dimethylaniline2-(p-N,N-Dimethylaminophenylazo)pyridine
Show more names
PADA, TRANS ISOMERPYRIDYLAZO-4-DIMETHYLANILINEPyridine-2-azo-p-dimethylaniline>N,N-dimethyl-4-(2-pyridylazo)aniline2-(4-DIMETHYLAMINOPHENYLAZO)PYRIDINETRANS-PYRIDINE-2-AZO-P-DIMETHYLANILINE2-(P-[DIMETHYLAMINO]PHENYLAZO)PYRIDINE
MFCD00010435Benzenamine, N,N-dimethyl-4-(2-pyridinylazo)-2-[[p-(dimethylamino)phenyl]azo]pyridineN,N-dimethyl-4-[2-(pyridin-2-yl)diazen-1-yl]anilineNSC 9358MLS000737906CHEMBL1984524Pyridine, 2-[[p-(dimethylamino)phenyl]azo]-

Database identifiers

CAS
13103-75-8、77038-70-1
PubChem CID
81528
DTXSID
DTXSID001302586
ChEMBL
CHEMBL1984524
UNII
A28D5TXV9W
EC Number
236-026-6
Nikkaji
J208.861D

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
40.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
244

Physicochemical properties

Melting point
108 · 108-110°C
Boiling point
392.8 · 392.8±22.0 °C(Predicted)
Density
1.08 · 1.08±0.1 g/cm3(Predicted)
pka
3.27 · 3.27±0.10(Predicted)
form
powder to crystal
color
Orange to Amber to Dark red
Water Solubility
21.27 mg/L · 21.27mg/L(temperature not stated)
BRN
185623 · 185623
CAS DataBase Reference
13103 · 13103-75-8(CAS DataBase Reference)
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
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety 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 · 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)

Aggregated GHS information provided per 44 reports by companies from 4 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

hs_code
2933.39.9200
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Related reactions

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Compound notes

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26 · 26-36
HS Code
2933.39 · 2933.39.9200