1,4-Benzenediamine, N1,N1-bis(4-aminophenyl)-

HCID 80083
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
5981-09-9
Standard SMILES
Nc1ccc(N(c2ccc(N)cc2)c2ccc(N)cc2)cc1
InChIKey
SNLFYGIUTYKKOE-UHFFFAOYSA-N
Molecular formula
C18H18N4
Average molar mass
290.4 g/mol
Monoisotopic mass
290.15314659

Names & identifiers

Preferred name
1,4-Benzenediamine, N1,N1-bis(4-aminophenyl)-
IUPAC
4-N,4-N-bis(4-aminophenyl)benzene-1,4-diamine
English name
TAPA
Molecular formula
C18H18N4
Molecular weight
290.36

Names & synonyms

5981-09-91,4-Benzenediamine, N,N-bis(4-aminophenyl)-N,N-Bis(4-aminophenyl)-1,4-benzenediamineN,N-Bis(4-aminophenyl)benzene-1,4-diamineDTXSID2064074EINECS 227-791-71,4-Benzenediamine, N1,N1-bis(4-aminophenyl)-RefChem:415902DTXCID8042717227-791-7Tris(4-aminophenyl)amine4,4',4''-Triaminotriphenylamine
Show more names
N1,N1-Bis(4-aminophenyl)-1,4-benzenediamine1490808JACS-5981-9-9N1,N1-Bis(4-aMinophenyl)-4,4',4''-Nitrilotrianiline4,4',4''-Nitrilotrisaniline
TAPAN1,N1-bis(4-aminophenyl)benzene-1,4-diamineTRIS(P-AMINOPHENYL)AMINEMFCD007783014-N,4-N-bis(4-aminophenyl)benzene-1,4-diamineN4,N4-bis(4-aminophenyl)benzene-1,4-diaminetris-(4-aminophenyl)aminetri(4-aminophenyl)amine

Database identifiers

CAS
5981-09-9
PubChem CID
80083
DTXSID
DTXSID2064074
EC Number
227-791-7
Nikkaji
J223.925F

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
81.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
22

Physicochemical properties

Melting point
230 °C · 230 °C
Boiling point
571.3 · 571.3±45.0 °C(Predicted)
Density
1.276 · 1.276±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
solubility
Soluble in DMSO, DMF, Insoluble in methanol & water
form
Solid

Safety & regulation

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 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 CategoriesSkin Irrit. 2 (100%)

Safety data

tsca
TSCA listed
hs_code
29215900
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,4-Benzenediamine, N1,N1-bis(4-aminophenyl)-: ACTIVE

Applications

UsesA fluorescent trifunctional highly symmetric probe. Shows remarkably high nonlinear optical properties.

Upstream & downstream products

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
河北汤武科技有限公司15632360893 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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