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1,3,5-Tri-2-naphthylbenzene

HCID 138906
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Basic information

CAS
7059-70-3
Standard SMILES
c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)cc(-c4ccc5ccccc5c4)c3)ccc2c1
InChIKey
AWIOMAWDKDFGDP-UHFFFAOYSA-N
Molecular formula
C36H24
Average molar mass
456.6 g/mol
Monoisotopic mass
456.18780077

Names & identifiers

Preferred name
1,3,5-Tri-2-naphthylbenzene
IUPAC
2-(3,5-dinaphthalen-2-ylphenyl)naphthalene
English name
1,3,5-Tri(1-naphthyl)benzene
Molecular formula
C36H24
Molecular weight
456.58

Names & synonyms

1,3,5-Tri-2-naphthylbenzene16322-13-71,3,5-Tri(naphthalen-2-yl)benzeneNaphthalene, 2,2',2''-(1,3,5-benzenetriyl)tris-2-(3,5-dinaphthalen-2-ylphenyl)naphthalene2-[3,5-bis(naphthalen-2-yl)phenyl]naphthaleneSCHEMBL7905146DTXSID802208851,3,5-tri-beta-naphthyl benzeneMFCD32206196AKOS037645265AS-59487
Show more names
1,3,5-Tri(1-naphthyl)benzene1,3,5-tris-(1'-naphthyl)benzene1,3,5-Tri(naphthalen-1-yl)benzene1,3,5-Tri(1-naphthyl)benzene - [T94285]Naphthalene, 1,1',1''-(1,3,5-benzenetriyl)tris-
2-[3,5-bis(2-naphthyl)phenyl]naphthaleneCS-0169826F746182,2',2''-(Benzene-1,3,5-triyl)trinaphthaleneF695838Naphthalene,2,2',2''-(1,3,5-benzenetriyl)tris-naphthalene, 2,2',2''-(1,2,5-benzenetriyl)tris-

Database identifiers

CAS
7059-70-3
PubChem CID
138906
DTXSID
DTXSID80220885
Nikkaji
J2.670.589D

Properties

Computed structural properties

XLogP
10.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
36
Formal charge
0
Complexity
602

Experimental & physicochemical properties

SpringerMaterials PropertiesFusion temperature

Physicochemical properties

Melting point
184 to · 184.0 to 188.0 °C
Boiling point
626.6 · 626.6±50.0 °C(Predicted)
Density
1.177 · 1.177±0.06 g/cm3(Predicted)
storage temp.
Room Temperature, under inert atmosphere
solubility
Chloroform (Sparingly), DMSO (Slightly)
form
Solid
color
Off-White to Pale Red
λmax
293 nm · 293nm(Cyclohexane)(lit.)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2902.90.9000
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Related reactions

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Compound notes

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HS Code
2902.9 · 2902.90.9000