Bianthronyl - ≥97% , CAS No.434-84-4

CAS: 434-84-4 Cat. No.: B151967 분자식: C₂₈H₁₈O₂ 분자량: 386.45 EC 번호: 635-142-8

등급 & 순도 ≥97%

Synonyms

UNII-PBH43F9Y7H | NSC 102943 | ZQXZUOJNJXNUEO-UHFFFAOYSA-N | [9,9'-Bianthracene]-10,10'(9H,9'H)-dione | NSC102943 | NSC-102943 | 10,10'-Dianthronyl | FT-0632132 | STK063038 | 10,10'-Dihydrodianthrone | SCHEMBL6903914 | (9,9'-Bianthracene)-10,10'(9H,9'H)-d

Storage

Room temperature

Shipped In

Normal

사양

동의어

UNII-PBH43F9Y7H | NSC 102943 | ZQXZUOJNJXNUEO-UHFFFAOYSA-N | [9,9'-Bianthracene]-10,10'(9H,9'H)-dione | NSC102943 | NSC-102943 | 10,10'-Dianthronyl | FT-0632132 | STK063038 | 10,10'-Dihydrodianthrone | SCHEMBL6903914 | (9,9'-Bianthracene)-10,10'(9H,9'H)-d

사양 및 순도

≥97%

보관 조건

Room temperature

배송

Normal

순수함

≥97%

이름과 식별자

Pubchem Sid

504756355

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756355

정식 스마일

C1=CC=C2C(=C1)C(C3=CC=CC=C3C2=O)C4C5=CC=CC=C5C(=O)C6=CC=CC=C46

IUPAC Name

10-(10-oxo-9H-anthracen-9-yl)-10H-anthracen-9-one

InChIKey

ZQXZUOJNJXNUEO-UHFFFAOYSA-N

INCHI

1S/C28H18O2/c29-27-21-13-5-1-9-17(21)25(18-10-2-6-14-22(18)27)26-19-11-3-7-15-23(19)28(30)24-16-8-4-12-20(24)26/h1-16,25-26H

이성체 SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3C2=O)C4C5=CC=CC=C5C(=O)C6=CC=CC=C46

분자량

386.45

Reaxy-Rn

1916440

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1916440&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Anthracenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenes
• Alternative Parents: Aryl ketones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Anthracene - Aryl ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as anthracenes. These are organic compounds containing a system of three linearly fused benzene rings.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

화학 및 물리적 특성

• 녹는점(°C): 272°C(dec.)(lit.)
• 분자량: 386.400 g/mol
• XLogP3: 6.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 386.131 Da
• Monoisotopic Mass: 386.131 Da
• Topological Polar Surface Area: 34.100 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 572.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 434-84-4, the molecular formula is C28H18O2, and the molecular weight is 386.45 g/mol. InChIKey ZQXZUOJNJXNUEO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.