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3-(4-Chlorophenyl)glutaric acid - 98%, high purity , CAS No.35271-74-0

COA

Grade & Purity:

≥98%

Cas Number: 35271-74-0
Molecular Weight: 242.66
MDL number: MFCD00190249
PubChem CID: 607276
PubChem SID: 488190689

In stock

Item Number

C106551

Grouped product items
SKU	Size	Availability	Price
C106551-5g	5g	10	$9.90
C106551-25g	25g	Available within 1-2 weeks(?) Item is derived from our semi-finished stock and is processed in 1-2 weeks.	$28.90
C106551-100g	100g	3	$76.90
C106551-500g	500g	1	$293.90

Basic Description

Synonyms	3-(4-chlorophenyl)pentanedioic acid \| 35271-74-0 \| 3-(4-Chlorophenyl)glutaric acid \| Pentanedioic acid, 3-(4-chlorophenyl)- \| 3-(4-Chlorophenyl) glutarate \| EINECS 252-477-1 \| MFCD00190249 \| 3-(4-CHLOROPHENYL)-PENTANEDIOIC ACID \| b-(4-Chlorophenyl) glutaric acid \| Maybridg
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Phenylpropanoids and polyketides
  - Class Phenylpropanoic acids

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
Class	Phenylpropanoic acids
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpropanoic acids
Alternative Parents	Chlorobenzenes Dicarboxylic acids and derivatives Aryl chlorides Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	3-phenylpropanoic-acid - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Aryl halide - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
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	488190689
IUPAC Name	3-(4-chlorophenyl)pentanedioic acid
INCHI	InChI=1S/C11H11ClO4/c12-9-3-1-7(2-4-9)8(5-10(13)14)6-11(15)16/h1-4,8H,5-6H2,(H,13,14)(H,15,16)
InChIKey	URXVLIVRJJNJII-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1C(CC(=O)O)CC(=O)O)Cl
Isomeric SMILES	C1=CC(=CC=C1C(CC(=O)O)CC(=O)O)Cl
Molecular Weight	242.66
Reaxy-Rn	1976828
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1976828&ln=

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

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

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
C2321013	Certificate of Analysis	Dec 12, 2024	C106551
I2227082	Certificate of Analysis	Jul 18, 2024	C106551
I2227233	Certificate of Analysis	Jul 18, 2024	C106551
I2227061	Certificate of Analysis	Jul 18, 2024	C106551
D1811122	Certificate of Analysis	Aug 02, 2023	C106551
D1811121	Certificate of Analysis	Aug 02, 2023	C106551
D1726054	Certificate of Analysis	Oct 17, 2022	C106551

Chemical and Physical Properties

Melt Point(°C)	164-168°C
Molecular Weight	242.650 g/mol
XLogP3	1.800
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	242.035 Da
Monoisotopic Mass	242.035 Da
Topological Polar Surface Area	74.600 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	243.000
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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