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(S)-2-Hydroxy-2-(4-methoxyphenyl)acetic Acid - 98%, high purity , CAS No.75172-66-6

COA

Grade & Purity:

≥98%

Cas Number: 75172-66-6
Molecular Weight: 182.17
PubChem CID: 6951706

In stock

Item Number

S194902

Grouped product items
SKU	Size	Availability	Price
S194902-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$40.90
S194902-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$185.90
S194902-10g	10g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$352.90

Basic Description

Synonyms	L-4-Methoxymandelic acid \| 75172-66-6 \| (S)-2-Hydroxy-2-(4-methoxyphenyl)acetic acid \| (2S)-2-hydroxy-2-(4-methoxyphenyl)acetic acid \| MFCD00754498 \| ?L-4-methoxymandelic acid \| SCHEMBL4634271 \| DTXSID40426245 \| FD1313 \| AKOS005146321 \| AKOS015851915 \| AC-23825 \| DS-14342 \| BB 026
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers
    - Subclass Anisoles

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Anisoles
Intermediate Tree Nodes	Not available
Direct Parent	Anisoles
Alternative Parents	Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Alpha hydroxy acids and derivatives Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Alpha-hydroxy acid - Monocyclic benzene moiety - Hydroxy acid - Secondary alcohol - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Alcohol - Carbonyl group - Organic oxygen compound - Organic oxide - Aromatic alcohol - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
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	(2S)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
INCHI	InChI=1S/C9H10O4/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5,8,10H,1H3,(H,11,12)/t8-/m0/s1
InChIKey	ITECRQOOEQWFPE-QMMMGPOBSA-N
Smiles	COC1=CC=C(C=C1)C(C(=O)O)O
Isomeric SMILES	COC1=CC=C(C=C1)[C@@H](C(=O)O)O
Molecular Weight	182.17
Reaxy-Rn	2212169
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2212169&ln=

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

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Lot Number	Certificate Type	Date	Item
K1929051	Certificate of Analysis	Sep 11, 2023	S194902

Chemical and Physical Properties

Melt Point(°C)	102-105℃
Molecular Weight	182.170 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	182.058 Da
Monoisotopic Mass	182.058 Da
Topological Polar Surface Area	66.800 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	172.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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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