Violanthrone 79 - ≥95%(HPLC) , CAS No.85652-50-2

CAS: 85652-50-2 Cat. No.: V162974 Molecular Weight: 712.93 PubChem CID: 16217791
AVAILABLE TO ORDER
GRADE & PURITY ≥95%(HPLC)
Synonyms
30,34-dioctoxynonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),22,24,26,28-hexadecaene-12,21-dione | EX-A4763 | 16,17-Bis(n-octyloxy)anthra[9,1,2-cde]benzo[rst]pentaphene
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
200mg
V162974-200mg
6

$9.90

$14.90
Save $5.00 (33.56%)
1g
V162974-1g
4

$32.90

$49.90
Save $17.00 (34.07%)
5g
V162974-5g
2

$109.90

$164.90
Save $55.00 (33.35%)
25g
V162974-25g
2

$307.90

$461.90
Save $154.00 (33.34%)
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Why this grade

≥95%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Product introduction

Violanthrone 79 is an n-channel organic semiconductor used for interface control of conventional n-type meta diode.

Specifications

Synonyms
30, 34-dioctoxynonacyclo[18.10.2.22, 5.03, 16.04, 13.06, 11.017, 31.022, 27.028, 32]tetratriaconta-1(30), 2(34), 3(16), 4(13), 5(33), 6, 8, 10, 14, 17(31), 18, 20(32), 22, 24, 26, 28-hexadecaene-12, 21-dione | EX-A4763 | 16, 17-Bis(n-octyloxy)anthra[9, 1, 2-cde]benzo[rst]pentaphene
Specifications & Purity
≥95%(HPLC)
Storage
Room temperature
Shipped In
Normal
Purity
≥95%(HPLC)
Names and Identifiers
Pubchem Sid488199257
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488199257
Canonical SmilesCCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC
IUPAC Name30,34-dioctoxynonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),22,24,26,28-hexadecaene-12,21-dione
InChIKeyLLPQZABTDLOYAL-UHFFFAOYSA-N
INCHI1S/C50H48O4/c1-3-5-7-9-11-17-27-53-41-29-39-31-19-13-15-21-35(31)49(51)37-25-23-33-34-24-26-38-44-40(32-20-14-16-22-36(32)50(38)52)30-42(54-28-18-12-10-8-6-4-2)48(46(34)44)47(41)45(33)43(37)39/h13-16,19-26,29-30H,3-12,17-18,27-28H2,1-2H3
Isomeric SMILES CCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCC
PubChem CID 16217791
Molecular Weight 712.93

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassPyrenes
SubclassBenzopyrenes
Intermediate Tree Nodes Not available
Direct ParentBenzopyrenes
Alternative Parents Chrysenes  Phenanthrols  Anthracenes  Alkyl aryl ethers  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homopolycyclic compounds
Substituents Benzo-a-pyrene - Chrysene - Phenanthrol - Phenanthrene - Anthracene - Alkyl aryl ether - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzopyrenes. These are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot NumberCertificate TypeDateItem
F1927060Certificate of AnalysisApr 13, 2023 V162974
J2215414Certificate of AnalysisJun 23, 2022 V162974
J2215488Certificate of AnalysisJun 23, 2022 V162974
J2215494Certificate of AnalysisJun 23, 2022 V162974
J2215495Certificate of AnalysisJun 23, 2022 V162974
L2509004Certificate of AnalysisJun 23, 2022 V162974
Chemical and Physical Properties
SolubilitySoluble in chloroform.
Melt Point(°C)199 °C
Molecular Weight712.900 g/mol
XLogP314.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count16
Exact Mass712.355 Da
Monoisotopic Mass712.355 Da
Topological Polar Surface Area52.600 Ų
Heavy Atom Count54
Formal Charge0
Complexity1180.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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