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2-Chloro-4-hydroxybenzoic acid hydrate - 98%, high purity , CAS No.440123-65-9

COA

Grade & Purity:

≥98%

Cas Number: 440123-65-9
Molecular Weight: 190.6
PubChem CID: 53395443

In stock

Item Number

C184555

Grouped product items
SKU	Size	Availability	Price	Qty
C184555-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$31.90
C184555-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$87.90

Discover 2-Chloro-4-hydroxybenzoic acid hydrate by Aladdin Scientific in 98% for only $31.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Chloro-4-hydroxybenzoic acid hydrate \| 440123-65-9 \| 2-chloro-4-hydroxybenzoic acid;hydrate \| MFCD00798116 \| 2-Chloro-4-hydroxybenzoicAcidHydrate \| C7H7ClO4 \| 2-Chloro-4-hydroxybenzoic acid hydrate 98+% \| SCHEMBL694945 \| DTXSID80694148 \| LVNLXWMDILTYQC-UHFFFAOYSA-N \| AKOS0
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Hydroxybenzoic acid derivatives
Alternative Parents	Halobenzoic acids 2-halobenzoic acids Benzoic acids M-chlorophenols Benzoyl derivatives 1-carboxy-2-haloaromatic compounds Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Vinylogous halides Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Hydroxybenzoic acid - Halobenzoic acid - 2-halobenzoic acid - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoic acid - 3-halophenol - 3-chlorophenol - Benzoyl - 1-carboxy-2-haloaromatic compound - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Chlorobenzene - Phenol - Aryl halide - Aryl chloride - Vinylogous halide - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. These are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups.
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	2-chloro-4-hydroxybenzoic acid;hydrate
INCHI	InChI=1S/C7H5ClO3.H2O/c8-6-3-4(9)1-2-5(6)7(10)11;/h1-3,9H,(H,10,11);1H2
InChIKey	LVNLXWMDILTYQC-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1O)Cl)C(=O)O.O
Isomeric SMILES	C1=CC(=C(C=C1O)Cl)C(=O)O.O
Molecular Weight	190.6
Reaxy-Rn	19868452
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19868452&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	190.580 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	190.003 Da
Monoisotopic Mass	190.003 Da
Topological Polar Surface Area	58.500 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	160.000
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	2

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