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Cinnolin-4-ol - 97%, high purity , CAS No.875-66-1

COA

Grade & Purity:

≥97%

Cas Number: 875-66-1
Molecular Weight: 146.15
PubChem CID: 255799

In stock

Item Number

C195487

Grouped product items
SKU	Size	Availability	Price
C195487-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$15.90
C195487-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$46.90
C195487-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$210.90

Basic Description

Synonyms	Cinnolin-4-ol \| 875-66-1 \| 4-Cinnolinol \| CINNOLIN-4(1H)-ONE \| 1H-cinnolin-4-one \| 18514-84-6 \| 4-HYDROXYCINNOLINE \| 4-Hydroxy-cinnoline \| 4(1H)-Cinnolinone \| 1,4-DIHYDROCINNOLIN-4-ONE \| NSC81669 \| KUS8838BCK \| MFCD00956158 \| MFCD08704234 \| NSC-81669 \| MLS000760649 \| 1H-cinnolin-4-one;h
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazanaphthalenes
    - Subclass Benzodiazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazanaphthalenes
Subclass	Benzodiazines
Intermediate Tree Nodes	Not available
Direct Parent	Cinnolines
Alternative Parents	Pyridazines and derivatives Benzenoids Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Cinnoline - Benzenoid - Pyridazine - Heteroaromatic compound - Vinylogous amide - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as cinnolines. These are organic aromatic compounds containing a benzene fused to a pyridazine ring.
External Descriptors	Not available
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

Names and Identifiers

IUPAC Name	1H-cinnolin-4-one
INCHI	InChI=1S/C8H6N2O/c11-8-5-9-10-7-4-2-1-3-6(7)8/h1-5H,(H,10,11)
InChIKey	UFMBERDMCRCVSM-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)C(=O)C=NN2
Isomeric SMILES	C1=CC=C2C(=C1)C(=O)C=NN2
Molecular Weight	146.15
Reaxy-Rn	118882
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=118882&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	146.150 g/mol
XLogP3	0.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	146.048 Da
Monoisotopic Mass	146.048 Da
Topological Polar Surface Area	41.500 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	200.000
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

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