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Pigment Red 4 , CAS No.2814-77-9

COA

Cas Number: 2814-77-9
Molecular Weight: 327.72
PubChem CID: 17778
PubChem SID: 488182411

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Item Number

P355209

Grouped product items
SKU	Size	Availability	Price
P355209-5g	5g	3	$26.90
P355209-25g	25g	1	$103.90
P355209-100g	100g	1	$289.90

View related series

Azobenzene (57) Six membered carbocyclic compound (243)

Basic Description

Synonyms	SCHEMBL341193 \| Vulcan Red R \| 1-[(2-chloro-4-nitrophenyl)diazenyl]naphthalen-2-ol \| Q27285609 \| D&C Red No. 36 \| EINECS 220-562-2 \| Red No. 228 \| 1-(2-chloro-4-nitrophenylazo)-2-naphthol \| 1-[(2-Chloro-4-nitrophenyl)azo]-2-naphthol \| CCRIS 4907 \| Permane
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Naphthalenes
    - Subclass Naphthols and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Naphthols and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Naphthols and derivatives
Alternative Parents	Nitrobenzenes Nitroaromatic compounds Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Azo compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	2-naphthol - Nitrobenzene - Nitroaromatic compound - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Azo compound - Organic nitro compound - C-nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic zwitterion - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthols and derivatives. These are naphthalene derivatives carrying one or more hydroxyl (-OH) groups at any ring position.
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

Pubchem Sid	488182411
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488182411
IUPAC Name	1-[(2-chloro-4-nitrophenyl)diazenyl]naphthalen-2-ol
INCHI	InChI=1S/C16H10ClN3O3/c17-13-9-11(20(22)23)6-7-14(13)18-19-16-12-4-2-1-3-10(12)5-8-15(16)21/h1-9,21H
InChIKey	XLTMWFMRJZDFFD-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)O
Isomeric SMILES	C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)O
RTECS	QL3436000
PubChem CID	17778
Molecular Weight	327.72

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

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7 results found

Lot Number	Certificate Type	Date	Item
F2315215	Certificate of Analysis	Jun 05, 2023	P355209
F2314167	Certificate of Analysis	Jun 05, 2023	P355209
F2315216	Certificate of Analysis	Jun 05, 2023	P355209
F2314166	Certificate of Analysis	Jun 05, 2023	P355209
F2315206	Certificate of Analysis	Jun 05, 2023	P355209
F2314164	Certificate of Analysis	Jun 05, 2023	P355209
F2301626	Certificate of Analysis	May 25, 2023	P355209

Chemical and Physical Properties

Molecular Weight	327.720 g/mol
XLogP3	5.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	327.041 Da
Monoisotopic Mass	327.041 Da
Topological Polar Surface Area	90.800 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	456.000
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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