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Perylene (purified by sublimation)

Catalog Number
ACM198550-1
CAS Number
198-55-0
Product Name
Perylene (purified by sublimation)
Structure
Category
Other Material Building Blocks; Carbon Nanomaterials; Molecular Conductors; Organic Light-Emitting Diode (OLED) Materials
Synonyms
Dibenz[de,kl]anthracene (purified by sublimation)
Peri-dinaphthalene (purified by sublimation)
IUPAC Name
perylene
Molecular Weight
252.32
Molecular Formula
C20H12
Canonical SMILES
C1=CC2=C3C(=C1)C4=CC=CC5=C4C(=CC=C5)C3=CC=C2
InChI
InChI=1S/C20H12/c1-5-13-6-2-11-17-18-12-4-8-14-7-3-10-16(20(14)18)15(9-1)19(13)17/h1-12H
InChI Key
CSHWQDPOILHKBI-UHFFFAOYSA-N
Boiling Point
350-400 (sublimes)
Melting Point
278 °C
Purity
>99.0%(GC)
Density
1.35
Solubility
1.59e-09 M;In water, 0.0004 mg/L at 25 °C;Freely soluble in carbon disulfide, chloroform; moderately soluble in benzene; slightly in ether, alcohol, acetone; very sparingly soluble in petroleum ether.;Slightly soluble in ethyl alcohol, ethyl ether; very soluble in acetone, chloroform
Appearance
Light yellow to Brown powder to crystaline
Storage
Store under inert gas
Color/Form
Yellow to colorless crystals from toluene;Golden-brown yellow plates from benzene, acetic acid
Complexity
304
Covalently-Bonded Unit Count
1
EC Number
205-900-9
Exact Mass
252.0939g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heat of Vaporization
89.9 kJ/mol (323-473 K)
Heavy Atom Count
20
Log P
6.25 (LogP);log Kow = 6.30
MDL Number
MFCD00004142
MeSH Entry Terms
Peri Dinaphthalene;Peri-Dinaphthalene;Perilene;Perylene
Monoisotopic Mass
252.0939g/mol
NSC Number
6512
Other Experimental
Photo-oxidizable in presence of acids; forms deep-brown molecular compounds with halogens; can be hydrogenated to tetradecahydroperylene; reacts with nitrogen dioxide to form nitro derivatives;Enthalpy of fusion: 32.58 kJ/mol at 551.29 K;Henry's Law constant= 4.2X10-7 atm cu-m/mol at 25 °C (estimated from vapor pressure and water solubility)
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Refractive Index
1.48
Rotatable Bond Count
0
Signal Word
Warning
Specific Gravity
0.87
Stability
Stable under recommended storage conditions.;Photo-oxidizable in the presence of acids
UNII
5QD5427UN7
Vapor Pressure
5.25e-09 mmHg;5.0X10-10 mm Hg at 25 °C (extrapolated from measurements at higher temperatures)
XLogP3
5.8
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